2-(6-fluoro-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid

C14H15FN2O2 — CID 60785476

IUPAC2-(6-fluoro-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid
SMILESO=C(O)C1CCCCC1c1nc2ccc(F)cc2[nH]1
InChIInChI=1S/C14H15FN2O2/c15-8-5-6-11-12(7-8)17-13(16-11)9-3-1-2-4-10(9)14(18)19/h5-7,9-10H,1-4H2,(H,16,17)(H,18,19)
InChIKeyNZJZXWLLHKHCQP-UHFFFAOYSA-N
MW262.28 g/mol
LogP3.06
Rot. Bonds2

About 2-(6-fluoro-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid

2-(6-fluoro-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid (PubChem CID 60785476) has the molecular formula C14H15FN2O2 and a molecular weight of 262.28 g/mol. Its IUPAC name is 2-(6-fluoro-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid.

Molecular Properties

Compound Name2-(6-fluoro-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid
PubChem CID60785476
Molecular FormulaC14H15FN2O2
Molecular Weight262.28 g/mol
Exact Mass262.11
IUPAC Name2-(6-fluoro-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid
SMILESO=C(O)C1CCCCC1c1nc2ccc(F)cc2[nH]1
InChIInChI=1S/C14H15FN2O2/c15-8-5-6-11-12(7-8)17-13(16-11)9-3-1-2-4-10(9)14(18)19/h5-7,9-10H,1-4H2,(H,16,17)(H,18,19)
InChIKeyNZJZXWLLHKHCQP-UHFFFAOYSA-N
XLogP3.06
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.28
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(6-fluoro-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid 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

2-(6-methyl-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid
CID 43379455
3-(6-fluoro-1H-benzimidazol-2-yl)cyclopentane-1-carboxylic acid
CID 103551613
2-(6-fluoro-1H-benzimidazol-2-yl)cyclopentan-1-amine
CID 64812865
2-(5-amino-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexane-1-carboxylic acid
CID 79820848
2-(5-fluoro-1-methylbenzimidazol-2-yl)cyclohexane-1-carboxylic acid
CID 60783416
1-(6-fluoro-1H-benzimidazol-2-yl)piperidine-4-carboxylic acid
CID 84614259
2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-1-carboxylic acid
CID 103979455
2,1,3-benzoxadiazol-5-yl-[(2S)-2-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]methanone
CID 95897263
2-(5,6-dichloro-1H-benzimidazol-2-yl)cyclopropane-1-carboxylic acid
CID 82001126
2-cyclopentyl-3H-benzimidazole-5-carboxylic acid
CID 43168815
2-(azepan-1-yl)-1-[(2R)-2-(6-fluoro-1H-benzimidazol-2-yl)pyrrolidin-1-yl]ethanone
CID 95206662
[2-(dimethylamino)phenyl]-[(2R)-2-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]methanone
CID 95896300

Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoro-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid?
The IUPAC name of 2-(6-fluoro-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid (CID 60785476) is 2-(6-fluoro-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid.
What is the SMILES notation for 2-(6-fluoro-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid?
The canonical SMILES for 2-(6-fluoro-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid is O=C(O)C1CCCCC1c1nc2ccc(F)cc2[nH]1.
What is the InChIKey of 2-(6-fluoro-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid?
The InChIKey is NZJZXWLLHKHCQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O2/c15-8-5-6-11-12(7-8)17-13(16-11)9-3-1-2-4-10(9)14(18)19/h5-7,9-10H,1-4H2,(H,16,17)(H,18,19).
What are the key properties of 2-(6-fluoro-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid?
2-(6-fluoro-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid has a molecular weight of 262.28 g/mol, XLogP of 3.06, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoro-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid is sourced from PubChem (CID 60785476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).