1-(2-cyclopentylethyl)-5-fluorobenzimidazol-2-amine

C14H18FN3 — CID 54932894

IUPAC1-(2-cyclopentylethyl)-5-fluorobenzimidazol-2-amine
SMILESNc1nc2cc(F)ccc2n1CCC1CCCC1
InChIInChI=1S/C14H18FN3/c15-11-5-6-13-12(9-11)17-14(16)18(13)8-7-10-3-1-2-4-10/h5-6,9-10H,1-4,7-8H2,(H2,16,17)
InChIKeyYVPKVTVBFPZAKT-UHFFFAOYSA-N
MW247.32 g/mol
LogP3.34
Rot. Bonds3

About 1-(2-cyclopentylethyl)-5-fluorobenzimidazol-2-amine

1-(2-cyclopentylethyl)-5-fluorobenzimidazol-2-amine (PubChem CID 54932894) has the molecular formula C14H18FN3 and a molecular weight of 247.32 g/mol. Its IUPAC name is 1-(2-cyclopentylethyl)-5-fluorobenzimidazol-2-amine.

Molecular Properties

Compound Name1-(2-cyclopentylethyl)-5-fluorobenzimidazol-2-amine
PubChem CID54932894
Molecular FormulaC14H18FN3
Molecular Weight247.32 g/mol
Exact Mass247.15
IUPAC Name1-(2-cyclopentylethyl)-5-fluorobenzimidazol-2-amine
SMILESNc1nc2cc(F)ccc2n1CCC1CCCC1
InChIInChI=1S/C14H18FN3/c15-11-5-6-13-12(9-11)17-14(16)18(13)8-7-10-3-1-2-4-10/h5-6,9-10H,1-4,7-8H2,(H2,16,17)
InChIKeyYVPKVTVBFPZAKT-UHFFFAOYSA-N
XLogP3.34
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.32
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2-cyclopentylethyl)-5-fluorobenzimidazol-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 1-(2-cyclopentylethyl)-5-fluorobenzimidazol-2-amine?
The IUPAC name of 1-(2-cyclopentylethyl)-5-fluorobenzimidazol-2-amine (CID 54932894) is 1-(2-cyclopentylethyl)-5-fluorobenzimidazol-2-amine.
What is the SMILES notation for 1-(2-cyclopentylethyl)-5-fluorobenzimidazol-2-amine?
The canonical SMILES for 1-(2-cyclopentylethyl)-5-fluorobenzimidazol-2-amine is Nc1nc2cc(F)ccc2n1CCC1CCCC1.
What is the InChIKey of 1-(2-cyclopentylethyl)-5-fluorobenzimidazol-2-amine?
The InChIKey is YVPKVTVBFPZAKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FN3/c15-11-5-6-13-12(9-11)17-14(16)18(13)8-7-10-3-1-2-4-10/h5-6,9-10H,1-4,7-8H2,(H2,16,17).
What are the key properties of 1-(2-cyclopentylethyl)-5-fluorobenzimidazol-2-amine?
1-(2-cyclopentylethyl)-5-fluorobenzimidazol-2-amine has a molecular weight of 247.32 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopentylethyl)-5-fluorobenzimidazol-2-amine is sourced from PubChem (CID 54932894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).