N-cyclopentyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide

C21H28N4O2 — CID 109068202

IUPACN-cyclopentyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCCC1CCCCN1C(=O)c1nc(C(=O)NC2CCCC2)c2ccccn12
InChIInChI=1S/C21H28N4O2/c1-2-16-11-5-7-13-24(16)21(27)19-23-18(17-12-6-8-14-25(17)19)20(26)22-15-9-3-4-10-15/h6,8,12,14-16H,2-5,7,9-11,13H2,1H3,(H,22,26)
InChIKeyAYYUPEYOTYSZSV-UHFFFAOYSA-N
MW368.48 g/mol
LogP3.41
Rot. Bonds4

About N-cyclopentyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide

N-cyclopentyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 109068202) has the molecular formula C21H28N4O2 and a molecular weight of 368.48 g/mol. Its IUPAC name is N-cyclopentyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
PubChem CID109068202
Molecular FormulaC21H28N4O2
Molecular Weight368.48 g/mol
Exact Mass368.22
IUPAC NameN-cyclopentyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCCC1CCCCN1C(=O)c1nc(C(=O)NC2CCCC2)c2ccccn12
InChIInChI=1S/C21H28N4O2/c1-2-16-11-5-7-13-24(16)21(27)19-23-18(17-12-6-8-14-25(17)19)20(26)22-15-9-3-4-10-15/h6,8,12,14-16H,2-5,7,9-11,13H2,1H3,(H,22,26)
InChIKeyAYYUPEYOTYSZSV-UHFFFAOYSA-N
XLogP3.41
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-cyclopentyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide (CID 109068202) is N-cyclopentyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-cyclopentyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-cyclopentyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide is CCC1CCCCN1C(=O)c1nc(C(=O)NC2CCCC2)c2ccccn12.
What is the InChIKey of N-cyclopentyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is AYYUPEYOTYSZSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N4O2/c1-2-16-11-5-7-13-24(16)21(27)19-23-18(17-12-6-8-14-25(17)19)20(26)22-15-9-3-4-10-15/h6,8,12,14-16H,2-5,7,9-11,13H2,1H3,(H,22,26).
What are the key properties of N-cyclopentyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
N-cyclopentyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 368.48 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 109068202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).