7-chloro-1-(1-cyclopropylethyl)benzimidazol-2-amine

C12H14ClN3 — CID 43662113

IUPAC7-chloro-1-(1-cyclopropylethyl)benzimidazol-2-amine
SMILESCC(C1CC1)n1c(N)nc2cccc(Cl)c21
InChIInChI=1S/C12H14ClN3/c1-7(8-5-6-8)16-11-9(13)3-2-4-10(11)15-12(16)14/h2-4,7-8H,5-6H2,1H3,(H2,14,15)
InChIKeyAAKIKMGKBAPQCC-UHFFFAOYSA-N
MW235.72 g/mol
LogP3.24
Rot. Bonds2

About 7-chloro-1-(1-cyclopropylethyl)benzimidazol-2-amine

7-chloro-1-(1-cyclopropylethyl)benzimidazol-2-amine (PubChem CID 43662113) has the molecular formula C12H14ClN3 and a molecular weight of 235.72 g/mol. Its IUPAC name is 7-chloro-1-(1-cyclopropylethyl)benzimidazol-2-amine.

Molecular Properties

Compound Name7-chloro-1-(1-cyclopropylethyl)benzimidazol-2-amine
PubChem CID43662113
Molecular FormulaC12H14ClN3
Molecular Weight235.72 g/mol
Exact Mass235.09
IUPAC Name7-chloro-1-(1-cyclopropylethyl)benzimidazol-2-amine
SMILESCC(C1CC1)n1c(N)nc2cccc(Cl)c21
InChIInChI=1S/C12H14ClN3/c1-7(8-5-6-8)16-11-9(13)3-2-4-10(11)15-12(16)14/h2-4,7-8H,5-6H2,1H3,(H2,14,15)
InChIKeyAAKIKMGKBAPQCC-UHFFFAOYSA-N
XLogP3.24
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.72
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 7-chloro-1-(1-cyclopropylethyl)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-propan-2-ylbenzimidazol-2-yl)-cyclopropylmethanamine
CID 55108333
7-chloro-1-(4,4,4-trifluorobutan-2-yl)benzimidazol-2-amine
CID 114129976
7-chloro-1-(1-thiophen-3-ylethyl)benzimidazol-2-amine
CID 62843686
7-chloro-1-hexan-3-ylbenzimidazol-2-amine
CID 62117285
7-chloro-1-cyclopentylbenzimidazol-2-amine
CID 43661582
7-chlorobenzimidazole-1,2-diamine
CID 84618531
1-[1-(2-chlorophenyl)ethyl]-7-methylbenzimidazol-2-amine
CID 115552367
3-(2-amino-7-chlorobenzimidazol-1-yl)-1-methylpyrrolidin-2-one
CID 106258982
7-chloro-1-(3-methyl-2-propan-2-ylbutyl)benzimidazol-2-amine
CID 102906797
7-chloro-1-(2-propan-2-yloxyethyl)benzimidazol-2-amine
CID 104763128
5-chloro-1-(1-cyclohexylethyl)benzimidazol-2-amine
CID 63546409
7-chloro-1-[(4-methylcyclohexyl)methyl]benzimidazol-2-amine
CID 63547309

Frequently Asked Questions

What is the IUPAC name of 7-chloro-1-(1-cyclopropylethyl)benzimidazol-2-amine?
The IUPAC name of 7-chloro-1-(1-cyclopropylethyl)benzimidazol-2-amine (CID 43662113) is 7-chloro-1-(1-cyclopropylethyl)benzimidazol-2-amine.
What is the SMILES notation for 7-chloro-1-(1-cyclopropylethyl)benzimidazol-2-amine?
The canonical SMILES for 7-chloro-1-(1-cyclopropylethyl)benzimidazol-2-amine is CC(C1CC1)n1c(N)nc2cccc(Cl)c21.
What is the InChIKey of 7-chloro-1-(1-cyclopropylethyl)benzimidazol-2-amine?
The InChIKey is AAKIKMGKBAPQCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14ClN3/c1-7(8-5-6-8)16-11-9(13)3-2-4-10(11)15-12(16)14/h2-4,7-8H,5-6H2,1H3,(H2,14,15).
What are the key properties of 7-chloro-1-(1-cyclopropylethyl)benzimidazol-2-amine?
7-chloro-1-(1-cyclopropylethyl)benzimidazol-2-amine has a molecular weight of 235.72 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-1-(1-cyclopropylethyl)benzimidazol-2-amine is sourced from PubChem (CID 43662113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).