3-(2-ethylpiperidine-1-carbonyl)-N-methyl-N-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide

C23H30N4O2 — CID 109077263

IUPAC3-(2-ethylpiperidine-1-carbonyl)-N-methyl-N-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
SMILESCCC1CCCCN1C(=O)c1nc(C(=O)N(C)c2ccccc2)c2n1CCCC2
InChIInChI=1S/C23H30N4O2/c1-3-17-11-7-9-15-26(17)23(29)21-24-20(19-14-8-10-16-27(19)21)22(28)25(2)18-12-5-4-6-13-18/h4-6,12-13,17H,3,7-11,14-16H2,1-2H3
InChIKeyJAMTUYFKONUKDE-UHFFFAOYSA-N
MW394.52 g/mol
LogP3.90
Rot. Bonds4

About 3-(2-ethylpiperidine-1-carbonyl)-N-methyl-N-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide

3-(2-ethylpiperidine-1-carbonyl)-N-methyl-N-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 109077263) has the molecular formula C23H30N4O2 and a molecular weight of 394.52 g/mol. Its IUPAC name is 3-(2-ethylpiperidine-1-carbonyl)-N-methyl-N-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound Name3-(2-ethylpiperidine-1-carbonyl)-N-methyl-N-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
PubChem CID109077263
Molecular FormulaC23H30N4O2
Molecular Weight394.52 g/mol
Exact Mass394.24
IUPAC Name3-(2-ethylpiperidine-1-carbonyl)-N-methyl-N-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
SMILESCCC1CCCCN1C(=O)c1nc(C(=O)N(C)c2ccccc2)c2n1CCCC2
InChIInChI=1S/C23H30N4O2/c1-3-17-11-7-9-15-26(17)23(29)21-24-20(19-14-8-10-16-27(19)21)22(28)25(2)18-12-5-4-6-13-18/h4-6,12-13,17H,3,7-11,14-16H2,1-2H3
InChIKeyJAMTUYFKONUKDE-UHFFFAOYSA-N
XLogP3.90
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.52
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-ethylpiperidine-1-carbonyl)-N-methyl-N-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of 3-(2-ethylpiperidine-1-carbonyl)-N-methyl-N-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide (CID 109077263) is 3-(2-ethylpiperidine-1-carbonyl)-N-methyl-N-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for 3-(2-ethylpiperidine-1-carbonyl)-N-methyl-N-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for 3-(2-ethylpiperidine-1-carbonyl)-N-methyl-N-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide is CCC1CCCCN1C(=O)c1nc(C(=O)N(C)c2ccccc2)c2n1CCCC2.
What is the InChIKey of 3-(2-ethylpiperidine-1-carbonyl)-N-methyl-N-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is JAMTUYFKONUKDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N4O2/c1-3-17-11-7-9-15-26(17)23(29)21-24-20(19-14-8-10-16-27(19)21)22(28)25(2)18-12-5-4-6-13-18/h4-6,12-13,17H,3,7-11,14-16H2,1-2H3.
What are the key properties of 3-(2-ethylpiperidine-1-carbonyl)-N-methyl-N-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
3-(2-ethylpiperidine-1-carbonyl)-N-methyl-N-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 394.52 g/mol, XLogP of 3.90, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethylpiperidine-1-carbonyl)-N-methyl-N-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 109077263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).