7-chloro-2-cyclopropyl-1-(furan-2-ylmethyl)benzimidazole

C15H13ClN2O — CID 46310193

IUPAC7-chloro-2-cyclopropyl-1-(furan-2-ylmethyl)benzimidazole
SMILESClc1cccc2nc(C3CC3)n(Cc3ccco3)c12
InChIInChI=1S/C15H13ClN2O/c16-12-4-1-5-13-14(12)18(9-11-3-2-8-19-11)15(17-13)10-6-7-10/h1-5,8,10H,6-7,9H2
InChIKeyPJVZCDXYDHXQNO-UHFFFAOYSA-N
MW272.74 g/mol
LogP4.21
Rot. Bonds3

About 7-chloro-2-cyclopropyl-1-(furan-2-ylmethyl)benzimidazole

7-chloro-2-cyclopropyl-1-(furan-2-ylmethyl)benzimidazole (PubChem CID 46310193) has the molecular formula C15H13ClN2O and a molecular weight of 272.74 g/mol. Its IUPAC name is 7-chloro-2-cyclopropyl-1-(furan-2-ylmethyl)benzimidazole.

Molecular Properties

Compound Name7-chloro-2-cyclopropyl-1-(furan-2-ylmethyl)benzimidazole
PubChem CID46310193
Molecular FormulaC15H13ClN2O
Molecular Weight272.74 g/mol
Exact Mass272.07
IUPAC Name7-chloro-2-cyclopropyl-1-(furan-2-ylmethyl)benzimidazole
SMILESClc1cccc2nc(C3CC3)n(Cc3ccco3)c12
InChIInChI=1S/C15H13ClN2O/c16-12-4-1-5-13-14(12)18(9-11-3-2-8-19-11)15(17-13)10-6-7-10/h1-5,8,10H,6-7,9H2
InChIKeyPJVZCDXYDHXQNO-UHFFFAOYSA-N
XLogP4.21
TPSA30.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.74
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 7-chloro-2-cyclopropyl-1-(furan-2-ylmethyl)benzimidazole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-chloro-2-cyclopropyl-1-(furan-2-ylmethyl)benzimidazole?
The IUPAC name of 7-chloro-2-cyclopropyl-1-(furan-2-ylmethyl)benzimidazole (CID 46310193) is 7-chloro-2-cyclopropyl-1-(furan-2-ylmethyl)benzimidazole.
What is the SMILES notation for 7-chloro-2-cyclopropyl-1-(furan-2-ylmethyl)benzimidazole?
The canonical SMILES for 7-chloro-2-cyclopropyl-1-(furan-2-ylmethyl)benzimidazole is Clc1cccc2nc(C3CC3)n(Cc3ccco3)c12.
What is the InChIKey of 7-chloro-2-cyclopropyl-1-(furan-2-ylmethyl)benzimidazole?
The InChIKey is PJVZCDXYDHXQNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2O/c16-12-4-1-5-13-14(12)18(9-11-3-2-8-19-11)15(17-13)10-6-7-10/h1-5,8,10H,6-7,9H2.
What are the key properties of 7-chloro-2-cyclopropyl-1-(furan-2-ylmethyl)benzimidazole?
7-chloro-2-cyclopropyl-1-(furan-2-ylmethyl)benzimidazole has a molecular weight of 272.74 g/mol, XLogP of 4.21, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2-cyclopropyl-1-(furan-2-ylmethyl)benzimidazole is sourced from PubChem (CID 46310193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).