(2-ethylpiperidin-1-yl)-[3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone

C21H28N4O2 — CID 109068501

IUPAC(2-ethylpiperidin-1-yl)-[3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone
SMILESCCC1CCCCN1C(=O)c1nc(C(=O)N2CCCCC2)n2ccccc12
InChIInChI=1S/C21H28N4O2/c1-2-16-10-4-8-14-24(16)20(26)18-17-11-5-9-15-25(17)19(22-18)21(27)23-12-6-3-7-13-23/h5,9,11,15-16H,2-4,6-8,10,12-14H2,1H3
InChIKeyLXVAFJIMIFPYJK-UHFFFAOYSA-N
MW368.48 g/mol
LogP3.37
Rot. Bonds3

About (2-ethylpiperidin-1-yl)-[3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone

(2-ethylpiperidin-1-yl)-[3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone (PubChem CID 109068501) has the molecular formula C21H28N4O2 and a molecular weight of 368.48 g/mol. Its IUPAC name is (2-ethylpiperidin-1-yl)-[3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone.

Molecular Properties

Compound Name(2-ethylpiperidin-1-yl)-[3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone
PubChem CID109068501
Molecular FormulaC21H28N4O2
Molecular Weight368.48 g/mol
Exact Mass368.22
IUPAC Name(2-ethylpiperidin-1-yl)-[3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone
SMILESCCC1CCCCN1C(=O)c1nc(C(=O)N2CCCCC2)n2ccccc12
InChIInChI=1S/C21H28N4O2/c1-2-16-10-4-8-14-24(16)20(26)18-17-11-5-9-15-25(17)19(22-18)21(27)23-12-6-3-7-13-23/h5,9,11,15-16H,2-4,6-8,10,12-14H2,1H3
InChIKeyLXVAFJIMIFPYJK-UHFFFAOYSA-N
XLogP3.37
TPSA57.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

azepan-1-yl-[3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone
CID 109071586
[3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]-(3-methylpiperidin-1-yl)methanone
CID 109071584
1-(2-ethylpiperidine-1-carbonyl)-N-propan-2-ylimidazo[1,5-a]pyridine-3-carboxamide
CID 109066389
N-cyclohexyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109068588
N-cyclopentyl-3-(2-ethylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109068202
(2-ethylpiperidin-1-yl)-(3-methylsulfonylimidazo[1,5-a]pyridin-1-yl)methanone
CID 51094587
3-(2-ethylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-1-carboxamide
CID 109071587
1-(2-ethylpiperidine-1-carbonyl)-N-(furan-2-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109070184
1-(2-ethylpiperidine-1-carbonyl)-N-(pyridin-3-ylmethyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109070682
[3-(4-methylpiperazine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]-piperidin-1-ylmethanone
CID 109068367
1-[4-[3-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carbonyl]piperazin-1-yl]ethanone
CID 109068040
1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide
CID 109071234

Frequently Asked Questions

What is the IUPAC name of (2-ethylpiperidin-1-yl)-[3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone?
The IUPAC name of (2-ethylpiperidin-1-yl)-[3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone (CID 109068501) is (2-ethylpiperidin-1-yl)-[3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone.
What is the SMILES notation for (2-ethylpiperidin-1-yl)-[3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone?
The canonical SMILES for (2-ethylpiperidin-1-yl)-[3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone is CCC1CCCCN1C(=O)c1nc(C(=O)N2CCCCC2)n2ccccc12.
What is the InChIKey of (2-ethylpiperidin-1-yl)-[3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone?
The InChIKey is LXVAFJIMIFPYJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N4O2/c1-2-16-10-4-8-14-24(16)20(26)18-17-11-5-9-15-25(17)19(22-18)21(27)23-12-6-3-7-13-23/h5,9,11,15-16H,2-4,6-8,10,12-14H2,1H3.
What are the key properties of (2-ethylpiperidin-1-yl)-[3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone?
(2-ethylpiperidin-1-yl)-[3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone has a molecular weight of 368.48 g/mol, XLogP of 3.37, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylpiperidin-1-yl)-[3-(piperidine-1-carbonyl)imidazo[1,5-a]pyridin-1-yl]methanone is sourced from PubChem (CID 109068501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).