N-[(4-methoxyphenyl)methyl]-3-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide

C21H22N4O4 — CID 109069381

IUPACN-[(4-methoxyphenyl)methyl]-3-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCOc1ccc(CNC(=O)c2nc(C(=O)N3CCOCC3)n3ccccc23)cc1
InChIInChI=1S/C21H22N4O4/c1-28-16-7-5-15(6-8-16)14-22-20(26)18-17-4-2-3-9-25(17)19(23-18)21(27)24-10-12-29-13-11-24/h2-9H,10-14H2,1H3,(H,22,26)
InChIKeyKGPSDKQUCCRDLJ-UHFFFAOYSA-N
MW394.43 g/mol
LogP1.75
Rot. Bonds5

About N-[(4-methoxyphenyl)methyl]-3-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide

N-[(4-methoxyphenyl)methyl]-3-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 109069381) has the molecular formula C21H22N4O4 and a molecular weight of 394.43 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-3-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-3-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
PubChem CID109069381
Molecular FormulaC21H22N4O4
Molecular Weight394.43 g/mol
Exact Mass394.16
IUPAC NameN-[(4-methoxyphenyl)methyl]-3-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCOc1ccc(CNC(=O)c2nc(C(=O)N3CCOCC3)n3ccccc23)cc1
InChIInChI=1S/C21H22N4O4/c1-28-16-7-5-15(6-8-16)14-22-20(26)18-17-4-2-3-9-25(17)19(23-18)21(27)24-10-12-29-13-11-24/h2-9H,10-14H2,1H3,(H,22,26)
InChIKeyKGPSDKQUCCRDLJ-UHFFFAOYSA-N
XLogP1.75
TPSA85.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.43
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(4-chlorophenyl)methyl]-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109069288
N-[(4-methylphenyl)methyl]-3-(4-methylpiperazine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109069940
N-(3-methylbutyl)-3-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109069396
N-(2-methoxyethyl)-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109068979
3-(azepane-1-carbonyl)-N-(4-methoxyphenyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109071776
3-(4-ethylpiperazine-1-carbonyl)-N-(pyridin-4-ylmethyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109070021
N-(3-methoxyphenyl)-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109069342
N-(4-methoxyphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109068814
N-methyl-3-(morpholine-4-carbonyl)-N-phenylimidazo[1,5-a]pyridine-1-carboxamide
CID 109069407
N-[(4-methoxyphenyl)methyl]morpholine-4-carboxamide
CID 669628
3-(azepane-1-carbonyl)-N-(pyridin-3-ylmethyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109070651
3-N-[2-(4-methoxyphenyl)ethyl]-1-N-(2-methylpropyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109067421

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-3-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-3-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide (CID 109069381) is N-[(4-methoxyphenyl)methyl]-3-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-3-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-3-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide is COc1ccc(CNC(=O)c2nc(C(=O)N3CCOCC3)n3ccccc23)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-3-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is KGPSDKQUCCRDLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N4O4/c1-28-16-7-5-15(6-8-16)14-22-20(26)18-17-4-2-3-9-25(17)19(23-18)21(27)24-10-12-29-13-11-24/h2-9H,10-14H2,1H3,(H,22,26).
What are the key properties of N-[(4-methoxyphenyl)methyl]-3-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
N-[(4-methoxyphenyl)methyl]-3-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 394.43 g/mol, XLogP of 1.75, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]-3-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 109069381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).