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

C22H24N4O3 — CID 109068814

IUPACN-(4-methoxyphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCOc1ccc(NC(=O)c2nc(C(=O)N3CCC(C)CC3)n3ccccc23)cc1
InChIInChI=1S/C22H24N4O3/c1-15-10-13-25(14-11-15)22(28)20-24-19(18-5-3-4-12-26(18)20)21(27)23-16-6-8-17(29-2)9-7-16/h3-9,12,15H,10-11,13-14H2,1-2H3,(H,23,27)
InChIKeyXNQWJAKRAKGDNF-UHFFFAOYSA-N
MW392.46 g/mol
LogP3.47
Rot. Bonds4

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

N-(4-methoxyphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 109068814) has the molecular formula C22H24N4O3 and a molecular weight of 392.46 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
PubChem CID109068814
Molecular FormulaC22H24N4O3
Molecular Weight392.46 g/mol
Exact Mass392.18
IUPAC NameN-(4-methoxyphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCOc1ccc(NC(=O)c2nc(C(=O)N3CCC(C)CC3)n3ccccc23)cc1
InChIInChI=1S/C22H24N4O3/c1-15-10-13-25(14-11-15)22(28)20-24-19(18-5-3-4-12-26(18)20)21(27)23-16-6-8-17(29-2)9-7-16/h3-9,12,15H,10-11,13-14H2,1-2H3,(H,23,27)
InChIKeyXNQWJAKRAKGDNF-UHFFFAOYSA-N
XLogP3.47
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide (CID 109068814) is N-(4-methoxyphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide is COc1ccc(NC(=O)c2nc(C(=O)N3CCC(C)CC3)n3ccccc23)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is XNQWJAKRAKGDNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O3/c1-15-10-13-25(14-11-15)22(28)20-24-19(18-5-3-4-12-26(18)20)21(27)23-16-6-8-17(29-2)9-7-16/h3-9,12,15H,10-11,13-14H2,1-2H3,(H,23,27).
What are the key properties of N-(4-methoxyphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
N-(4-methoxyphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 392.46 g/mol, XLogP of 3.47, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 109068814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).