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

C22H30N4O2 — CID 109068588

IUPACN-cyclohexyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCCC1CCCCN1C(=O)c1nc(C(=O)NC2CCCCC2)c2ccccn12
InChIInChI=1S/C22H30N4O2/c1-2-17-12-6-8-14-25(17)22(28)20-24-19(18-13-7-9-15-26(18)20)21(27)23-16-10-4-3-5-11-16/h7,9,13,15-17H,2-6,8,10-12,14H2,1H3,(H,23,27)
InChIKeyRKDGJDKQCCDHKO-UHFFFAOYSA-N
MW382.51 g/mol
LogP3.80
Rot. Bonds4

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

N-cyclohexyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 109068588) has the molecular formula C22H30N4O2 and a molecular weight of 382.51 g/mol. Its IUPAC name is N-cyclohexyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
PubChem CID109068588
Molecular FormulaC22H30N4O2
Molecular Weight382.51 g/mol
Exact Mass382.24
IUPAC NameN-cyclohexyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
SMILESCCC1CCCCN1C(=O)c1nc(C(=O)NC2CCCCC2)c2ccccn12
InChIInChI=1S/C22H30N4O2/c1-2-17-12-6-8-14-25(17)22(28)20-24-19(18-13-7-9-15-26(18)20)21(27)23-16-10-4-3-5-11-16/h7,9,13,15-17H,2-6,8,10-12,14H2,1H3,(H,23,27)
InChIKeyRKDGJDKQCCDHKO-UHFFFAOYSA-N
XLogP3.80
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.51
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-cyclohexyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide (CID 109068588) is N-cyclohexyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide is CCC1CCCCN1C(=O)c1nc(C(=O)NC2CCCCC2)c2ccccn12.
What is the InChIKey of N-cyclohexyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is RKDGJDKQCCDHKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N4O2/c1-2-17-12-6-8-14-25(17)22(28)20-24-19(18-13-7-9-15-26(18)20)21(27)23-16-10-4-3-5-11-16/h7,9,13,15-17H,2-6,8,10-12,14H2,1H3,(H,23,27).
What are the key properties of N-cyclohexyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide?
N-cyclohexyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 382.51 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 109068588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).