3-cyclopentyl-2-propylimidazo[4,5-b]pyridine-6-carboxylic acid

C15H19N3O2 — CID 82488832

IUPAC3-cyclopentyl-2-propylimidazo[4,5-b]pyridine-6-carboxylic acid
SMILESCCCc1nc2cc(C(=O)O)cnc2n1C1CCCC1
InChIInChI=1S/C15H19N3O2/c1-2-5-13-17-12-8-10(15(19)20)9-16-14(12)18(13)11-6-3-4-7-11/h8-9,11H,2-7H2,1H3,(H,19,20)
InChIKeyORIBODPZCZJCFD-UHFFFAOYSA-N
MW273.34 g/mol
LogP3.20
Rot. Bonds4

About 3-cyclopentyl-2-propylimidazo[4,5-b]pyridine-6-carboxylic acid

3-cyclopentyl-2-propylimidazo[4,5-b]pyridine-6-carboxylic acid (PubChem CID 82488832) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 3-cyclopentyl-2-propylimidazo[4,5-b]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name3-cyclopentyl-2-propylimidazo[4,5-b]pyridine-6-carboxylic acid
PubChem CID82488832
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name3-cyclopentyl-2-propylimidazo[4,5-b]pyridine-6-carboxylic acid
SMILESCCCc1nc2cc(C(=O)O)cnc2n1C1CCCC1
InChIInChI=1S/C15H19N3O2/c1-2-5-13-17-12-8-10(15(19)20)9-16-14(12)18(13)11-6-3-4-7-11/h8-9,11H,2-7H2,1H3,(H,19,20)
InChIKeyORIBODPZCZJCFD-UHFFFAOYSA-N
XLogP3.20
TPSA68.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-cyclopropyl-2-[[4-(fluoromethyl)cyclohexyl]methyl]imidazo[4,5-b]pyridine-6-carboxylic acid
CID 163563835
2-butyl-3-methylimidazo[4,5-b]pyridine-6-carboxylic acid
CID 82475545
6-chloro-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine
CID 82144465
3-cyclohexyl-2-propylbenzimidazole-4-carboxylic acid
CID 115932845
3-cyclobutyl-2-propylbenzimidazole-4-carboxylic acid
CID 112577260
2-(2,2-dimethylpropyl)-3-methylimidazo[4,5-b]pyridine-6-carboxylic acid
CID 82479909
2-cyclopentyl-3-propan-2-ylimidazo[4,5-b]pyridine-6-carboxylic acid
CID 82488833
6-bromo-2-(2-chloroethyl)-3-cyclobutylimidazo[4,5-b]pyridine
CID 79302688
6-naphthalen-2-yl-3-piperidin-4-yl-2-propylimidazo[4,5-b]pyridine
CID 57425348
3-butyl-2-methylimidazo[4,5-b]pyridine-6-carboxylic acid
CID 82475538
1-cyclohexyl-2-propylbenzimidazol-5-amine
CID 62507665
2-methyl-2-(6-methyl-2-propylimidazo[4,5-b]pyridin-3-yl)propanoic acid
CID 82061486

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-2-propylimidazo[4,5-b]pyridine-6-carboxylic acid?
The IUPAC name of 3-cyclopentyl-2-propylimidazo[4,5-b]pyridine-6-carboxylic acid (CID 82488832) is 3-cyclopentyl-2-propylimidazo[4,5-b]pyridine-6-carboxylic acid.
What is the SMILES notation for 3-cyclopentyl-2-propylimidazo[4,5-b]pyridine-6-carboxylic acid?
The canonical SMILES for 3-cyclopentyl-2-propylimidazo[4,5-b]pyridine-6-carboxylic acid is CCCc1nc2cc(C(=O)O)cnc2n1C1CCCC1.
What is the InChIKey of 3-cyclopentyl-2-propylimidazo[4,5-b]pyridine-6-carboxylic acid?
The InChIKey is ORIBODPZCZJCFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-2-5-13-17-12-8-10(15(19)20)9-16-14(12)18(13)11-6-3-4-7-11/h8-9,11H,2-7H2,1H3,(H,19,20).
What are the key properties of 3-cyclopentyl-2-propylimidazo[4,5-b]pyridine-6-carboxylic acid?
3-cyclopentyl-2-propylimidazo[4,5-b]pyridine-6-carboxylic acid has a molecular weight of 273.34 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-2-propylimidazo[4,5-b]pyridine-6-carboxylic acid is sourced from PubChem (CID 82488832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).