7-chloro-1-(4-propylcyclohexyl)benzimidazol-2-amine

C16H22ClN3 — CID 63546773

IUPAC7-chloro-1-(4-propylcyclohexyl)benzimidazol-2-amine
SMILESCCCC1CCC(n2c(N)nc3cccc(Cl)c32)CC1
InChIInChI=1S/C16H22ClN3/c1-2-4-11-7-9-12(10-8-11)20-15-13(17)5-3-6-14(15)19-16(20)18/h3,5-6,11-12H,2,4,7-10H2,1H3,(H2,18,19)
InChIKeyPOMZGKGLXFBKSO-UHFFFAOYSA-N
MW291.83 g/mol
LogP4.80
Rot. Bonds3

About 7-chloro-1-(4-propylcyclohexyl)benzimidazol-2-amine

7-chloro-1-(4-propylcyclohexyl)benzimidazol-2-amine (PubChem CID 63546773) has the molecular formula C16H22ClN3 and a molecular weight of 291.83 g/mol. Its IUPAC name is 7-chloro-1-(4-propylcyclohexyl)benzimidazol-2-amine.

Molecular Properties

Compound Name7-chloro-1-(4-propylcyclohexyl)benzimidazol-2-amine
PubChem CID63546773
Molecular FormulaC16H22ClN3
Molecular Weight291.83 g/mol
Exact Mass291.15
IUPAC Name7-chloro-1-(4-propylcyclohexyl)benzimidazol-2-amine
SMILESCCCC1CCC(n2c(N)nc3cccc(Cl)c32)CC1
InChIInChI=1S/C16H22ClN3/c1-2-4-11-7-9-12(10-8-11)20-15-13(17)5-3-6-14(15)19-16(20)18/h3,5-6,11-12H,2,4,7-10H2,1H3,(H2,18,19)
InChIKeyPOMZGKGLXFBKSO-UHFFFAOYSA-N
XLogP4.80
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.83
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 7-chloro-1-(4-propylcyclohexyl)benzimidazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-chloro-1-cyclopentylbenzimidazol-2-amine
CID 43661582
7-chloro-1-(1,1-dioxothian-4-yl)benzimidazol-2-amine
CID 43662181
7-chloro-1-[(4S)-1-methylazepan-4-yl]benzimidazol-2-amine
CID 156742611
3-(7-chloro-1-cyclopropylbenzimidazol-2-yl)pentan-3-amine
CID 79803543
5-methyl-3-(4-propylcyclohexyl)imidazo[4,5-b]pyridin-2-amine
CID 81136422
7-chloro-1-[(4-methylcyclohexyl)methyl]benzimidazol-2-amine
CID 63547309
7-chloro-1-(oxan-3-yl)benzimidazol-2-amine
CID 63363887
5-fluoro-1-(4-propylcyclohexyl)benzimidazol-2-amine
CID 63546950
(1S)-1-(7-chloro-1-cyclopropylbenzimidazol-2-yl)ethanamine
CID 83868081
1-(7-chloro-1-cyclopropylbenzimidazol-2-yl)-2,2-dimethylpropan-1-amine
CID 54920072
2-(7-chloro-1-cyclopropylbenzimidazol-2-yl)-2-methoxyethanamine
CID 114144451
7-chloro-1-cyclopropyl-2-(diethoxymethyl)benzimidazole
CID 63770797

Frequently Asked Questions

What is the IUPAC name of 7-chloro-1-(4-propylcyclohexyl)benzimidazol-2-amine?
The IUPAC name of 7-chloro-1-(4-propylcyclohexyl)benzimidazol-2-amine (CID 63546773) is 7-chloro-1-(4-propylcyclohexyl)benzimidazol-2-amine.
What is the SMILES notation for 7-chloro-1-(4-propylcyclohexyl)benzimidazol-2-amine?
The canonical SMILES for 7-chloro-1-(4-propylcyclohexyl)benzimidazol-2-amine is CCCC1CCC(n2c(N)nc3cccc(Cl)c32)CC1.
What is the InChIKey of 7-chloro-1-(4-propylcyclohexyl)benzimidazol-2-amine?
The InChIKey is POMZGKGLXFBKSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22ClN3/c1-2-4-11-7-9-12(10-8-11)20-15-13(17)5-3-6-14(15)19-16(20)18/h3,5-6,11-12H,2,4,7-10H2,1H3,(H2,18,19).
What are the key properties of 7-chloro-1-(4-propylcyclohexyl)benzimidazol-2-amine?
7-chloro-1-(4-propylcyclohexyl)benzimidazol-2-amine has a molecular weight of 291.83 g/mol, XLogP of 4.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-1-(4-propylcyclohexyl)benzimidazol-2-amine is sourced from PubChem (CID 63546773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).