IUPAC name
5-ethyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione
SMILES
CCC1(CCC(C)C)C(=O)NC(=O)NC1=O
Compound class
Hypnotics and Sedatives; GABA Modulators; Nervous System; Psycholeptics; Barbiturates, Plain; CYP2A6 Inhibitors; CYP2A6 Inhibitors (strong); CYP2A6 Inhibitors (moderate); CYP2A6 Inducers; CYP2A6 Inducers (strong);
Therapeutic area
Common name
Amobarbital
IUPAC name
5-ethyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione
SMILES
CCC1(CCC(C)C)C(=O)NC(=O)NC1=O
INCHI
InChI=1S/C11H18N2O3/c1-4-11(6-5-7(2)3)8(14)12-10(16)13-9(11)15/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16)
FORMULA
C11H18N2O3
Common name
Amobarbital
IUPAC name
5-ethyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione
Molecular weight
226.272
clogP
1.707
clogS
-3.180
HBond Acceptor
3
HBond Donor
2
Total Polar Surface Area
75.27
Number of Rings
1
Rotatable Bond
4
