3-cyclopentyl-N-[1-(2-methoxyphenoxy)propan-2-yl]imidazo[4,5-b]pyridine-6-carboxamide

C22H26N4O3 — CID 176504062

IUPAC3-cyclopentyl-N-[1-(2-methoxyphenoxy)propan-2-yl]imidazo[4,5-b]pyridine-6-carboxamide
SMILESCOc1ccccc1OCC(C)NC(=O)c1cnc2c(c1)ncn2C1CCCC1
InChIInChI=1S/C22H26N4O3/c1-15(13-29-20-10-6-5-9-19(20)28-2)25-22(27)16-11-18-21(23-12-16)26(14-24-18)17-7-3-4-8-17/h5-6,9-12,14-15,17H,3-4,7-8,13H2,1-2H3,(H,25,27)
InChIKeyCFIMDIMVUISMCC-UHFFFAOYSA-N
MW394.48 g/mol
LogP3.75
Rot. Bonds7

About 3-cyclopentyl-N-[1-(2-methoxyphenoxy)propan-2-yl]imidazo[4,5-b]pyridine-6-carboxamide

3-cyclopentyl-N-[1-(2-methoxyphenoxy)propan-2-yl]imidazo[4,5-b]pyridine-6-carboxamide (PubChem CID 176504062) has the molecular formula C22H26N4O3 and a molecular weight of 394.48 g/mol. Its IUPAC name is 3-cyclopentyl-N-[1-(2-methoxyphenoxy)propan-2-yl]imidazo[4,5-b]pyridine-6-carboxamide.

Molecular Properties

Compound Name3-cyclopentyl-N-[1-(2-methoxyphenoxy)propan-2-yl]imidazo[4,5-b]pyridine-6-carboxamide
PubChem CID176504062
Molecular FormulaC22H26N4O3
Molecular Weight394.48 g/mol
Exact Mass394.20
IUPAC Name3-cyclopentyl-N-[1-(2-methoxyphenoxy)propan-2-yl]imidazo[4,5-b]pyridine-6-carboxamide
SMILESCOc1ccccc1OCC(C)NC(=O)c1cnc2c(c1)ncn2C1CCCC1
InChIInChI=1S/C22H26N4O3/c1-15(13-29-20-10-6-5-9-19(20)28-2)25-22(27)16-11-18-21(23-12-16)26(14-24-18)17-7-3-4-8-17/h5-6,9-12,14-15,17H,3-4,7-8,13H2,1-2H3,(H,25,27)
InChIKeyCFIMDIMVUISMCC-UHFFFAOYSA-N
XLogP3.75
TPSA78.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.48
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(2S)-1-(2-methoxyphenoxy)propan-2-yl]cyclopentanecarboxamide
CID 95706429
1-ethyl-N-[1-(2-methoxyphenoxy)propan-2-yl]pyrazole-4-carboxamide
CID 75371639
3-cyclopentyl-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[4,5-b]pyridine-6-carboxamide
CID 176504133
3-cyclopentyl-N-[(4,6-dimethyl-3-pyridinyl)methyl]imidazo[4,5-b]pyridine-6-carboxamide
CID 176505473
[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-6-yl]methanone
CID 176500900
3-cyclopropyl-N-[3-(2-methoxyethylcarbamoyl)-2-methylphenyl]imidazo[4,5-b]pyridine-6-carboxamide
CID 176501437
3-cyclopentyl-N-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]imidazo[4,5-b]pyridine-6-carboxamide
CID 176506847
N-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-3-propan-2-ylimidazo[4,5-b]pyridine-6-carboxamide
CID 176505585
N-[(1R)-1-(4-cyclopentyl-1,2,4-triazol-3-yl)ethyl]-2-methoxypyrimidine-5-carboxamide
CID 126426674
N-[(1S)-1-(4-cyclopentyl-1,2,4-triazol-3-yl)ethyl]-2-methoxypyrimidine-5-carboxamide
CID 126426673
N-[(2S)-1-(2-methoxyphenoxy)propan-2-yl]propanamide
CID 95397556
3-cyclopentyl-N-[4-(morpholin-4-ylmethyl)phenyl]imidazo[4,5-b]pyridine-6-carboxamide
CID 175645216

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-[1-(2-methoxyphenoxy)propan-2-yl]imidazo[4,5-b]pyridine-6-carboxamide?
The IUPAC name of 3-cyclopentyl-N-[1-(2-methoxyphenoxy)propan-2-yl]imidazo[4,5-b]pyridine-6-carboxamide (CID 176504062) is 3-cyclopentyl-N-[1-(2-methoxyphenoxy)propan-2-yl]imidazo[4,5-b]pyridine-6-carboxamide.
What is the SMILES notation for 3-cyclopentyl-N-[1-(2-methoxyphenoxy)propan-2-yl]imidazo[4,5-b]pyridine-6-carboxamide?
The canonical SMILES for 3-cyclopentyl-N-[1-(2-methoxyphenoxy)propan-2-yl]imidazo[4,5-b]pyridine-6-carboxamide is COc1ccccc1OCC(C)NC(=O)c1cnc2c(c1)ncn2C1CCCC1.
What is the InChIKey of 3-cyclopentyl-N-[1-(2-methoxyphenoxy)propan-2-yl]imidazo[4,5-b]pyridine-6-carboxamide?
The InChIKey is CFIMDIMVUISMCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O3/c1-15(13-29-20-10-6-5-9-19(20)28-2)25-22(27)16-11-18-21(23-12-16)26(14-24-18)17-7-3-4-8-17/h5-6,9-12,14-15,17H,3-4,7-8,13H2,1-2H3,(H,25,27).
What are the key properties of 3-cyclopentyl-N-[1-(2-methoxyphenoxy)propan-2-yl]imidazo[4,5-b]pyridine-6-carboxamide?
3-cyclopentyl-N-[1-(2-methoxyphenoxy)propan-2-yl]imidazo[4,5-b]pyridine-6-carboxamide has a molecular weight of 394.48 g/mol, XLogP of 3.75, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-[1-(2-methoxyphenoxy)propan-2-yl]imidazo[4,5-b]pyridine-6-carboxamide is sourced from PubChem (CID 176504062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).