Responsive image

Common name

N-(2,6-dimethylphenyl)formamide

IUPAC name

N-(2,6-dimethylphenyl)formamide

SMILES

O=CNc1c(cccc1C)C

Common name

N-(2,6-dimethylphenyl)formamide

IUPAC name

N-(2,6-dimethylphenyl)formamide

SMILES

O=CNc1c(cccc1C)C

INCHI

InChI=1S/C9H11NO/c1-7-4-3-5-8(2)9(7)10-6-11/h3-6H,1-2H3,(H,10,11)

FORMULA

C9H11NO

Responsive image

Common name

N-(2,6-dimethylphenyl)formamide

IUPAC name

N-(2,6-dimethylphenyl)formamide





Molecular weight

149.190

clogP

2.124

clogS

-2.698

Frequency

0.0065





HBond Acceptor

1

HBond Donor

1

Total Polar
Surface Area

29.1

Number of Rings

1

Rotatable Bond

1

Drug ID Common name Structure CAS Compound class Therapeutic area
FDBD00131 Ranolazine Responsive image Cardiovascular Agents; Sodium Channel Blockers; Cardiovascular System; Cardiac Therapy; CYP2D6 Inducers; CYP2D6 Inducers (strong); CYP3A4 Inhibitors; For the treatment of chronic angina. It should be used in combination with amlodipine, beta-blockers or nitrates.
FDBD00168 Lidocaine Responsive image Anti-Arrhythmia Agents; Voltage-Gated Sodium Channel Blockers; Anesthetics, Local; Anesthetics; Respiratory System; Ophthalmologicals; Sensory Organs; Throat Preparations; Dermatologicals; Nervous System; Cardiovascular System; Antiarrhythmics, Class I and Iii; Cardiac Therapy; Antiarrythmics, Class I and Iii; Antiarrhythmics, Class Ib; Local Anesthetics; Agents for Treatment of Hemorrhoids and Anal Fissures for Topical Use; Vasoprotectives; Anesthetics for Topical Use; Antipruritics, Incl. Antihistamines, Anesthetics, Etc.; Amides; Analgesics and Anesthetics; Otologicals; Cytochrome P-450 CYP1A2 Inhibitors; Cytochrome P-450 CYP2C9 Inhibitors; Cytochrome P-450 CYP1A2 Inducers; Cytochrome P-450 CYP2C8 Inhibitors; Cytochrome P-450 CYP2C9 Inducers; Cytochrome P-450 CYP2C8 Inducers; Cytochrome P-450 CYP2B6 Inducers; Cytochrome P-450 CYP2B6 Inhibitors; CYP2A6 Inhibitors; CYP2A6 Inhibitors (strong); CYP2A6 Inhibitors (moderate); CYP2A6 Inducers; CYP2A6 Inducers (strong); CYP2B6 Inhibitors (strong); CYP2D6 Inducers; CYP2D6 Inducers (strong); CYP3A4 Inhibitors; Combined Inhibitors of CYP3A4 and P-glycoprotein; For production of local or regional anesthesia by infiltration techniques such as percutaneous injection and intravenous regional anesthesia by peripheral nerve block techniques such as brachial plexus and intercostal and by central neural techniques such as lumbar and caudal epidural blocks.
FDBD00183 Ropivacaine Responsive image Anesthetics, Local; Anesthetics; Nervous System; Amides; Cytochrome P-450 CYP1A2 Inhibitors; Cytochrome P-450 CYP1A2 Inducers; Cytochrome P-450 CYP2B6 Inducers; Cytochrome P-450 CYP2B6 Inhibitors; CYP2B6 Inhibitors (strong); CYP2D6 Inducers; CYP2D6 Inducers (strong); CYP3A4 Inhibitors; Used in obstetric anesthesia and regional anesthesia for surgery.
FDBD00184 Bupivacaine Responsive image Anesthetics, Local; Anesthetics; Nervous System; Amides; Cytochrome P-450 CYP1A2 Inhibitors; Cytochrome P-450 CYP1A2 Inducers; Cytochrome P-450 CYP2C19 Inducers; CYP2D6 Inducers; CYP2D6 Inducers (strong); CYP3A4 Inhibitors; For the production of local or regional anesthesia or analgesia for surgery, for oral surgery procedures, for diagnostic and therapeutic procedures, and for obstetrical procedures.
FDBD00816 Mepivacaine Responsive image Anesthetics, Local; Anesthetics; Nervous System; Amides; For production of local or regional analgesia and anesthesia by local infiltration, peripheral nerve block techniques, and central neural techniques including epidural and caudal blocks.
FDBD00856 Levobupivacaine Responsive image Anesthetics, Local; Anesthetics; Nervous System; Amides; Cytochrome P-450 CYP1A2 Inhibitors; Cytochrome P-450 CYP1A2 Inducers; CYP3A4 Inhibitors; For the production of local or regional anesthesia for surgery and obstetrics, and for post-operative pain management.
FDBD00907 Tocainide Responsive image Anti-Arrhythmia Agents; Voltage-Gated Sodium Channel Blockers; Sodium Channel Blockers; Cardiovascular System; Antiarrhythmics, Class I and Iii; Cardiac Therapy; Antiarrythmics, Class I and Iii; Antiarrhythmics, Class Ib; Cytochrome P-450 CYP1A2 Inhibitors; Cytochrome P-450 CYP1A2 Inducers; For the treatment of documented ventricular arrhythmias, such as sustained ventricular tachycardia, that, in the judgment of the physician, are life-threatening.
FDBD01609 Etidocaine Responsive image Anesthetics, Local; Anesthetics; Nervous System; Amides;
FDBD02411 delachlor Responsive image Herbicide Herbicide
FDBD02412 dimethachlor Responsive image Herbicide Herbicide
19 , 2
FRAGNAME PDBID SIMILIRITY XSCORE SMILE HAC
4kiq_ligand_1_1.mol2 4kiq 0.941176 -7.14 c1(c(cccc1)NC=O)C 10
3b2w_ligand_1_0.mol2 3b2w 0.941176 -6.90 N(C=O)c1ccccc1C 10
2nyr_ligand_1_2.mol2 2nyr 0.941176 -6.83 N(C=O)c1ccccc1C 10
4x3u_ligand_1_2.mol2 4x3u 0.941176 -6.70 c1cc(c(cc1)C)NC=O 10
4x3u_ligand_1_7.mol2 4x3u 0.941176 -6.70 c1(ccccc1C)NC=O 10
4nwm_ligand_1_5.mol2 4nwm 0.941176 -6.30 c1ccc(c(c1)NC=O)C 10
2h9t_ligand_1_2.mol2 2h9t 0.941176 -6.15 N(C=O)c1ccccc1C 10
2nyr_ligand_1_7.mol2 2nyr 0.941176 -5.90 c1(ccccc1C)NC=O 10
4yv5_ligand_1_2.mol2 4yv5 0.941176 -5.75 c1cc(c(cc1)C)NC=O 10
307 , 31