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

C23H26N4O2 — CID 109068805

IUPACN-(4-ethylphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCCc1ccc(NC(=O)c2nc(C(=O)N3CCC(C)CC3)n3ccccc23)cc1
InChIInChI=1S/C23H26N4O2/c1-3-17-7-9-18(10-8-17)24-22(28)20-19-6-4-5-13-27(19)21(25-20)23(29)26-14-11-16(2)12-15-26/h4-10,13,16H,3,11-12,14-15H2,1-2H3,(H,24,28)
InChIKeyWPNFIHMSWJQACX-UHFFFAOYSA-N
MW390.49 g/mol
LogP4.02
Rot. Bonds4

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

N-(4-ethylphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 109068805) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is N-(4-ethylphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
PubChem CID109068805
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC NameN-(4-ethylphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCCc1ccc(NC(=O)c2nc(C(=O)N3CCC(C)CC3)n3ccccc23)cc1
InChIInChI=1S/C23H26N4O2/c1-3-17-7-9-18(10-8-17)24-22(28)20-19-6-4-5-13-27(19)21(25-20)23(29)26-14-11-16(2)12-15-26/h4-10,13,16H,3,11-12,14-15H2,1-2H3,(H,24,28)
InChIKeyWPNFIHMSWJQACX-UHFFFAOYSA-N
XLogP4.02
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-(4-ethylphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide (CID 109068805) is N-(4-ethylphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-(4-ethylphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-(4-ethylphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide is CCc1ccc(NC(=O)c2nc(C(=O)N3CCC(C)CC3)n3ccccc23)cc1.
What is the InChIKey of N-(4-ethylphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is WPNFIHMSWJQACX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c1-3-17-7-9-18(10-8-17)24-22(28)20-19-6-4-5-13-27(19)21(25-20)23(29)26-14-11-16(2)12-15-26/h4-10,13,16H,3,11-12,14-15H2,1-2H3,(H,24,28).
What are the key properties of N-(4-ethylphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
N-(4-ethylphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 390.49 g/mol, XLogP of 4.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 109068805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).