N-benzyl-N-methyl-1-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide

C22H24N4O2 — CID 109068377

IUPACN-benzyl-N-methyl-1-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESCN(Cc1ccccc1)C(=O)c1nc(C(=O)N2CCCCC2)c2ccccn12
InChIInChI=1S/C22H24N4O2/c1-24(16-17-10-4-2-5-11-17)22(28)20-23-19(18-12-6-9-15-26(18)20)21(27)25-13-7-3-8-14-25/h2,4-6,9-12,15H,3,7-8,13-14,16H2,1H3
InChIKeyRQNADGGDKWSMQM-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.23
Rot. Bonds4

About N-benzyl-N-methyl-1-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide

N-benzyl-N-methyl-1-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide (PubChem CID 109068377) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is N-benzyl-N-methyl-1-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-methyl-1-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
PubChem CID109068377
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC NameN-benzyl-N-methyl-1-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESCN(Cc1ccccc1)C(=O)c1nc(C(=O)N2CCCCC2)c2ccccn12
InChIInChI=1S/C22H24N4O2/c1-24(16-17-10-4-2-5-11-17)22(28)20-23-19(18-12-6-9-15-26(18)20)21(27)25-13-7-3-8-14-25/h2,4-6,9-12,15H,3,7-8,13-14,16H2,1H3
InChIKeyRQNADGGDKWSMQM-UHFFFAOYSA-N
XLogP3.23
TPSA57.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-1-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-benzyl-N-methyl-1-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide (CID 109068377) is N-benzyl-N-methyl-1-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-benzyl-N-methyl-1-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-benzyl-N-methyl-1-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide is CN(Cc1ccccc1)C(=O)c1nc(C(=O)N2CCCCC2)c2ccccn12.
What is the InChIKey of N-benzyl-N-methyl-1-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The InChIKey is RQNADGGDKWSMQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-24(16-17-10-4-2-5-11-17)22(28)20-23-19(18-12-6-9-15-26(18)20)21(27)25-13-7-3-8-14-25/h2,4-6,9-12,15H,3,7-8,13-14,16H2,1H3.
What are the key properties of N-benzyl-N-methyl-1-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
N-benzyl-N-methyl-1-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 3.23, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-1-(piperidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 109068377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).