3-cyclopentyl-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[4,5-b]pyridine-6-carboxamide

C21H24N4O2 — CID 176504133

IUPAC3-cyclopentyl-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[4,5-b]pyridine-6-carboxamide
SMILESCOc1ccc(CN(C)C(=O)c2cnc3c(c2)ncn3C2CCCC2)cc1
InChIInChI=1S/C21H24N4O2/c1-24(13-15-7-9-18(27-2)10-8-15)21(26)16-11-19-20(22-12-16)25(14-23-19)17-5-3-4-6-17/h7-12,14,17H,3-6,13H2,1-2H3
InChIKeySLUGXTHZSXWDMV-UHFFFAOYSA-N
MW364.45 g/mol
LogP3.83
Rot. Bonds5

About 3-cyclopentyl-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[4,5-b]pyridine-6-carboxamide

3-cyclopentyl-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[4,5-b]pyridine-6-carboxamide (PubChem CID 176504133) has the molecular formula C21H24N4O2 and a molecular weight of 364.45 g/mol. Its IUPAC name is 3-cyclopentyl-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[4,5-b]pyridine-6-carboxamide.

Molecular Properties

Compound Name3-cyclopentyl-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[4,5-b]pyridine-6-carboxamide
PubChem CID176504133
Molecular FormulaC21H24N4O2
Molecular Weight364.45 g/mol
Exact Mass364.19
IUPAC Name3-cyclopentyl-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[4,5-b]pyridine-6-carboxamide
SMILESCOc1ccc(CN(C)C(=O)c2cnc3c(c2)ncn3C2CCCC2)cc1
InChIInChI=1S/C21H24N4O2/c1-24(13-15-7-9-18(27-2)10-8-15)21(26)16-11-19-20(22-12-16)25(14-23-19)17-5-3-4-6-17/h7-12,14,17H,3-6,13H2,1-2H3
InChIKeySLUGXTHZSXWDMV-UHFFFAOYSA-N
XLogP3.83
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-benzyl-N-methyl-3-(oxan-4-yl)imidazo[4,5-b]pyridine-6-carboxamide
CID 175646445
3-cyclopropyl-N-(furan-3-ylmethyl)-N-methylimidazo[4,5-b]pyridine-6-carboxamide
CID 175645381
3-cyclopentyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)imidazo[4,5-b]pyridine-6-carboxamide
CID 175643815
1-cyclopentyl-N-[(4-methoxyphenyl)methyl]-N-methylpyrazole-4-carboxamide
CID 166264505
N-[(5-cyano-1-methylpyrazol-3-yl)methyl]-3-cyclopentyl-N-methylimidazo[4,5-b]pyridine-6-carboxamide
CID 176503136
N-benzyl-1-cyclopentyl-N-methylbenzimidazole-5-carboxamide
CID 3658169
N-[(4-methoxyphenyl)methyl]-N-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxamide
CID 24641346
3-cyclopentyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-propan-2-ylimidazo[4,5-b]pyridine-6-carboxamide
CID 176507155
(3-cyclopropylimidazo[4,5-b]pyridin-6-yl)-[2-[4-[(dimethylamino)methyl]phenyl]piperidin-1-yl]methanone
CID 176500830
5,6-dichloro-N-[(4-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide
CID 60631233
6-fluoro-N-[(4-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide
CID 63979680
N-methyl-3-(oxan-4-yl)-N-[(3-pyridin-4-yl-1,2-oxazol-5-yl)methyl]imidazo[4,5-b]pyridine-6-carboxamide
CID 176501303

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[4,5-b]pyridine-6-carboxamide?
The IUPAC name of 3-cyclopentyl-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[4,5-b]pyridine-6-carboxamide (CID 176504133) is 3-cyclopentyl-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[4,5-b]pyridine-6-carboxamide.
What is the SMILES notation for 3-cyclopentyl-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[4,5-b]pyridine-6-carboxamide?
The canonical SMILES for 3-cyclopentyl-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[4,5-b]pyridine-6-carboxamide is COc1ccc(CN(C)C(=O)c2cnc3c(c2)ncn3C2CCCC2)cc1.
What is the InChIKey of 3-cyclopentyl-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[4,5-b]pyridine-6-carboxamide?
The InChIKey is SLUGXTHZSXWDMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O2/c1-24(13-15-7-9-18(27-2)10-8-15)21(26)16-11-19-20(22-12-16)25(14-23-19)17-5-3-4-6-17/h7-12,14,17H,3-6,13H2,1-2H3.
What are the key properties of 3-cyclopentyl-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[4,5-b]pyridine-6-carboxamide?
3-cyclopentyl-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[4,5-b]pyridine-6-carboxamide has a molecular weight of 364.45 g/mol, XLogP of 3.83, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[4,5-b]pyridine-6-carboxamide is sourced from PubChem (CID 176504133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).