4-chloro-2-(2-methylcyclopentyl)-1H-benzimidazole

C13H15ClN2 — CID 107180152

IUPAC4-chloro-2-(2-methylcyclopentyl)-1H-benzimidazole
SMILESCC1CCCC1c1nc2c(Cl)cccc2[nH]1
InChIInChI=1S/C13H15ClN2/c1-8-4-2-5-9(8)13-15-11-7-3-6-10(14)12(11)16-13/h3,6-9H,2,4-5H2,1H3,(H,15,16)
InChIKeyRZBKQLRDWODGHA-UHFFFAOYSA-N
MW234.73 g/mol
LogP4.12
Rot. Bonds1

About 4-chloro-2-(2-methylcyclopentyl)-1H-benzimidazole

4-chloro-2-(2-methylcyclopentyl)-1H-benzimidazole (PubChem CID 107180152) has the molecular formula C13H15ClN2 and a molecular weight of 234.73 g/mol. Its IUPAC name is 4-chloro-2-(2-methylcyclopentyl)-1H-benzimidazole.

Molecular Properties

Compound Name4-chloro-2-(2-methylcyclopentyl)-1H-benzimidazole
PubChem CID107180152
Molecular FormulaC13H15ClN2
Molecular Weight234.73 g/mol
Exact Mass234.09
IUPAC Name4-chloro-2-(2-methylcyclopentyl)-1H-benzimidazole
SMILESCC1CCCC1c1nc2c(Cl)cccc2[nH]1
InChIInChI=1S/C13H15ClN2/c1-8-4-2-5-9(8)13-15-11-7-3-6-10(14)12(11)16-13/h3,6-9H,2,4-5H2,1H3,(H,15,16)
InChIKeyRZBKQLRDWODGHA-UHFFFAOYSA-N
XLogP4.12
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.73
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-chloro-1H-benzimidazol-2-yl)cyclopentan-1-amine
CID 64812039
4-chloro-2-(2,2-dimethylcyclopentyl)-1H-benzimidazole
CID 107180154
4-(4-chloro-1H-benzimidazol-2-yl)-N-propyloxolan-3-amine
CID 66254218
6-bromo-2-(2-methylcyclopentyl)-1H-benzimidazole
CID 107180157
4-chloro-2-(cycloheptylmethyl)-1H-benzimidazole
CID 114458303
4-chloro-2-(2,3-dihydro-1,4-benzodioxin-3-yl)-1H-benzimidazole
CID 60978794
2-(4-chloro-1H-benzimidazol-2-yl)-2-methylcyclopentan-1-amine
CID 82763076
2-(4-methylsulfonyl-1H-benzimidazol-2-yl)cyclohexan-1-amine
CID 82008430
4-chloro-2-methyl-1H-benzimidazole;ethane;1-methylazepane
CID 156742444
N-[(4-chloro-1H-benzimidazol-2-yl)methyl]cyclopropanamine
CID 60837999
4-chloro-2-ethoxy-1H-benzimidazole
CID 69014735
2-(2-bicyclo[2.2.1]heptanyl)-4-methoxy-1H-benzimidazole
CID 67368518

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(2-methylcyclopentyl)-1H-benzimidazole?
The IUPAC name of 4-chloro-2-(2-methylcyclopentyl)-1H-benzimidazole (CID 107180152) is 4-chloro-2-(2-methylcyclopentyl)-1H-benzimidazole.
What is the SMILES notation for 4-chloro-2-(2-methylcyclopentyl)-1H-benzimidazole?
The canonical SMILES for 4-chloro-2-(2-methylcyclopentyl)-1H-benzimidazole is CC1CCCC1c1nc2c(Cl)cccc2[nH]1.
What is the InChIKey of 4-chloro-2-(2-methylcyclopentyl)-1H-benzimidazole?
The InChIKey is RZBKQLRDWODGHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2/c1-8-4-2-5-9(8)13-15-11-7-3-6-10(14)12(11)16-13/h3,6-9H,2,4-5H2,1H3,(H,15,16).
What are the key properties of 4-chloro-2-(2-methylcyclopentyl)-1H-benzimidazole?
4-chloro-2-(2-methylcyclopentyl)-1H-benzimidazole has a molecular weight of 234.73 g/mol, XLogP of 4.12, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(2-methylcyclopentyl)-1H-benzimidazole is sourced from PubChem (CID 107180152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).