3-N-cyclopentyl-1-N-(3-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide

C21H22N4O3 — CID 109068336

IUPAC3-N-cyclopentyl-1-N-(3-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
SMILESCOc1cccc(NC(=O)c2nc(C(=O)NC3CCCC3)n3ccccc23)c1
InChIInChI=1S/C21H22N4O3/c1-28-16-10-6-9-15(13-16)23-20(26)18-17-11-4-5-12-25(17)19(24-18)21(27)22-14-7-2-3-8-14/h4-6,9-14H,2-3,7-8H2,1H3,(H,22,27)(H,23,26)
InChIKeyRCDABMQKDUISQH-UHFFFAOYSA-N
MW378.43 g/mol
LogP3.27
Rot. Bonds5

About 3-N-cyclopentyl-1-N-(3-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide

3-N-cyclopentyl-1-N-(3-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide (PubChem CID 109068336) has the molecular formula C21H22N4O3 and a molecular weight of 378.43 g/mol. Its IUPAC name is 3-N-cyclopentyl-1-N-(3-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N-cyclopentyl-1-N-(3-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
PubChem CID109068336
Molecular FormulaC21H22N4O3
Molecular Weight378.43 g/mol
Exact Mass378.17
IUPAC Name3-N-cyclopentyl-1-N-(3-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
SMILESCOc1cccc(NC(=O)c2nc(C(=O)NC3CCCC3)n3ccccc23)c1
InChIInChI=1S/C21H22N4O3/c1-28-16-10-6-9-15(13-16)23-20(26)18-17-11-4-5-12-25(17)19(24-18)21(27)22-14-7-2-3-8-14/h4-6,9-14H,2-3,7-8H2,1H3,(H,22,27)(H,23,26)
InChIKeyRCDABMQKDUISQH-UHFFFAOYSA-N
XLogP3.27
TPSA84.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.43
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-N-cyclohexyl-1-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068661
1-N-cyclohexyl-3-N-(4-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068614
methyl 3-[[3-(cyclopropylcarbamoyl)imidazo[1,5-a]pyridine-1-carbonyl]amino]benzoate
CID 109066768
3-N-cyclohexyl-1-N-cyclopentylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068157
3-N-cyclopropyl-1-N-(2-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066749
1-N-[2-(dimethylamino)ethyl]-3-N-(3-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109069638
1-N-(4-cyanophenyl)-3-N-cyclopentylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068351
3-N-cyclohexyl-1-N-(2,5-dimethylphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068666
N-(3-methoxyphenyl)-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109069342
1-N-tert-butyl-3-N-cycloheptylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071055
1-N-cyclopropyl-3-N-(2-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066589
1-N-(3-chloro-4-fluorophenyl)-3-N-cyclopropylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066744

Frequently Asked Questions

What is the IUPAC name of 3-N-cyclopentyl-1-N-(3-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The IUPAC name of 3-N-cyclopentyl-1-N-(3-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide (CID 109068336) is 3-N-cyclopentyl-1-N-(3-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide.
What is the SMILES notation for 3-N-cyclopentyl-1-N-(3-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The canonical SMILES for 3-N-cyclopentyl-1-N-(3-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide is COc1cccc(NC(=O)c2nc(C(=O)NC3CCCC3)n3ccccc23)c1.
What is the InChIKey of 3-N-cyclopentyl-1-N-(3-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
The InChIKey is RCDABMQKDUISQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N4O3/c1-28-16-10-6-9-15(13-16)23-20(26)18-17-11-4-5-12-25(17)19(24-18)21(27)22-14-7-2-3-8-14/h4-6,9-14H,2-3,7-8H2,1H3,(H,22,27)(H,23,26).
What are the key properties of 3-N-cyclopentyl-1-N-(3-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide?
3-N-cyclopentyl-1-N-(3-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide has a molecular weight of 378.43 g/mol, XLogP of 3.27, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-cyclopentyl-1-N-(3-methoxyphenyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide is sourced from PubChem (CID 109068336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).