N-cyclopentyl-1-methylbenzimidazol-2-amine

C13H17N3 — CID 923815

IUPACN-cyclopentyl-1-methylbenzimidazol-2-amine
SMILESCn1c(NC2CCCC2)nc2ccccc21
InChIInChI=1S/C13H17N3/c1-16-12-9-5-4-8-11(12)15-13(16)14-10-6-2-3-7-10/h4-5,8-10H,2-3,6-7H2,1H3,(H,14,15)
InChIKeyXGPPKIPYNHCSGG-UHFFFAOYSA-N
MW215.30 g/mol
LogP2.93
Rot. Bonds2

About N-cyclopentyl-1-methylbenzimidazol-2-amine

N-cyclopentyl-1-methylbenzimidazol-2-amine (PubChem CID 923815) has the molecular formula C13H17N3 and a molecular weight of 215.30 g/mol. Its IUPAC name is N-cyclopentyl-1-methylbenzimidazol-2-amine.

Molecular Properties

Compound NameN-cyclopentyl-1-methylbenzimidazol-2-amine
PubChem CID923815
Molecular FormulaC13H17N3
Molecular Weight215.30 g/mol
Exact Mass215.14
IUPAC NameN-cyclopentyl-1-methylbenzimidazol-2-amine
SMILESCn1c(NC2CCCC2)nc2ccccc21
InChIInChI=1S/C13H17N3/c1-16-12-9-5-4-8-11(12)15-13(16)14-10-6-2-3-7-10/h4-5,8-10H,2-3,6-7H2,1H3,(H,14,15)
InChIKeyXGPPKIPYNHCSGG-UHFFFAOYSA-N
XLogP2.93
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclopentyl-1-methylbenzimidazol-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

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-methylbenzimidazol-2-amine?
The IUPAC name of N-cyclopentyl-1-methylbenzimidazol-2-amine (CID 923815) is N-cyclopentyl-1-methylbenzimidazol-2-amine.
What is the SMILES notation for N-cyclopentyl-1-methylbenzimidazol-2-amine?
The canonical SMILES for N-cyclopentyl-1-methylbenzimidazol-2-amine is Cn1c(NC2CCCC2)nc2ccccc21.
What is the InChIKey of N-cyclopentyl-1-methylbenzimidazol-2-amine?
The InChIKey is XGPPKIPYNHCSGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3/c1-16-12-9-5-4-8-11(12)15-13(16)14-10-6-2-3-7-10/h4-5,8-10H,2-3,6-7H2,1H3,(H,14,15).
What are the key properties of N-cyclopentyl-1-methylbenzimidazol-2-amine?
N-cyclopentyl-1-methylbenzimidazol-2-amine has a molecular weight of 215.30 g/mol, XLogP of 2.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-methylbenzimidazol-2-amine is sourced from PubChem (CID 923815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).