N-ethyl-3-(3-methylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-1-carboxamide

C23H26N4O2 — CID 109071646

IUPACN-ethyl-3-(3-methylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-1-carboxamide
SMILESCCN(C(=O)c1nc(C(=O)N2CCCC(C)C2)n2ccccc12)c1ccccc1
InChIInChI=1S/C23H26N4O2/c1-3-26(18-11-5-4-6-12-18)22(28)20-19-13-7-8-15-27(19)21(24-20)23(29)25-14-9-10-17(2)16-25/h4-8,11-13,15,17H,3,9-10,14,16H2,1-2H3
InChIKeyHTVGWODQKVXYIH-UHFFFAOYSA-N
MW390.49 g/mol
LogP3.87
Rot. Bonds4

About N-ethyl-3-(3-methylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-1-carboxamide

N-ethyl-3-(3-methylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 109071646) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is N-ethyl-3-(3-methylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-3-(3-methylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-1-carboxamide
PubChem CID109071646
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC NameN-ethyl-3-(3-methylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-1-carboxamide
SMILESCCN(C(=O)c1nc(C(=O)N2CCCC(C)C2)n2ccccc12)c1ccccc1
InChIInChI=1S/C23H26N4O2/c1-3-26(18-11-5-4-6-12-18)22(28)20-19-13-7-8-15-27(19)21(24-20)23(29)25-14-9-10-17(2)16-25/h4-8,11-13,15,17H,3,9-10,14,16H2,1-2H3
InChIKeyHTVGWODQKVXYIH-UHFFFAOYSA-N
XLogP3.87
TPSA57.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(3-methylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-ethyl-3-(3-methylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-1-carboxamide (CID 109071646) is N-ethyl-3-(3-methylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-ethyl-3-(3-methylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-ethyl-3-(3-methylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-1-carboxamide is CCN(C(=O)c1nc(C(=O)N2CCCC(C)C2)n2ccccc12)c1ccccc1.
What is the InChIKey of N-ethyl-3-(3-methylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is HTVGWODQKVXYIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c1-3-26(18-11-5-4-6-12-18)22(28)20-19-13-7-8-15-27(19)21(24-20)23(29)25-14-9-10-17(2)16-25/h4-8,11-13,15,17H,3,9-10,14,16H2,1-2H3.
What are the key properties of N-ethyl-3-(3-methylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-1-carboxamide?
N-ethyl-3-(3-methylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 390.49 g/mol, XLogP of 3.87, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(3-methylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 109071646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).