2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-1-carboxylic acid

C12H13N3O2 — CID 103979455

IUPAC2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-1-carboxylic acid
SMILESO=C(O)C1CCCC1c1nc2ncccc2[nH]1
InChIInChI=1S/C12H13N3O2/c16-12(17)8-4-1-3-7(8)10-14-9-5-2-6-13-11(9)15-10/h2,5-8H,1,3-4H2,(H,16,17)(H,13,14,15)
InChIKeyPLXYQJPWPWIPKV-UHFFFAOYSA-N
MW231.25 g/mol
LogP1.93
Rot. Bonds2

About 2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-1-carboxylic acid

2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-1-carboxylic acid (PubChem CID 103979455) has the molecular formula C12H13N3O2 and a molecular weight of 231.25 g/mol. Its IUPAC name is 2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-1-carboxylic acid
PubChem CID103979455
Molecular FormulaC12H13N3O2
Molecular Weight231.25 g/mol
Exact Mass231.10
IUPAC Name2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-1-carboxylic acid
SMILESO=C(O)C1CCCC1c1nc2ncccc2[nH]1
InChIInChI=1S/C12H13N3O2/c16-12(17)8-4-1-3-7(8)10-14-9-5-2-6-13-11(9)15-10/h2,5-8H,1,3-4H2,(H,16,17)(H,13,14,15)
InChIKeyPLXYQJPWPWIPKV-UHFFFAOYSA-N
XLogP1.93
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.25
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-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-(5-amino-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexane-1-carboxylic acid
CID 79820848
2-[2-(trifluoromethyl)cyclohexyl]-1H-imidazo[4,5-b]pyridine
CID 104622377
2-(6-methyl-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid
CID 43379455
2-(6-fluoro-1H-benzimidazol-2-yl)cyclohexane-1-carboxylic acid
CID 60785476
cis-(1,3-dioxoisoindol-2-yl) (1S,2R)-2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopropane-1-carboxylate
CID 178202293
2-([1,3]thiazolo[5,4-b]pyridin-2-yl)cyclopentane-1-carboxylic acid
CID 103979407
2-(1-propan-2-ylpyrrolidin-2-yl)-1H-imidazo[4,5-b]pyridine
CID 117162576
2-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-imidazo[4,5-b]pyridine
CID 62719628
trans-(1S,2S)-2-pyrimidin-2-ylcyclobutane-1-carboxylic acid
CID 137356594
cis-(1R,2S)-2-(1H-imidazo[4,5-b]pyridin-2-yl)-N-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropane-1-carboxamide
CID 136589200
tert-butyl 4-(1H-imidazo[4,5-b]pyridin-2-yl)piperidine-1-carboxylate
CID 22308646
4-(1H-imidazo[4,5-b]pyridin-2-yl)-2,3,3-trimethylcyclohexan-1-amine
CID 102628123

Frequently Asked Questions

What is the IUPAC name of 2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-1-carboxylic acid?
The IUPAC name of 2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-1-carboxylic acid (CID 103979455) is 2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-1-carboxylic acid.
What is the SMILES notation for 2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-1-carboxylic acid?
The canonical SMILES for 2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-1-carboxylic acid is O=C(O)C1CCCC1c1nc2ncccc2[nH]1.
What is the InChIKey of 2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-1-carboxylic acid?
The InChIKey is PLXYQJPWPWIPKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2/c16-12(17)8-4-1-3-7(8)10-14-9-5-2-6-13-11(9)15-10/h2,5-8H,1,3-4H2,(H,16,17)(H,13,14,15).
What are the key properties of 2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-1-carboxylic acid?
2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-1-carboxylic acid has a molecular weight of 231.25 g/mol, XLogP of 1.93, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-imidazo[4,5-b]pyridin-2-yl)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 103979455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).