N-(2-cyanophenyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide

C22H25N5O2 — CID 109074925

IUPACN-(2-cyanophenyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
SMILESCC1CCN(C(=O)c2nc(C(=O)Nc3ccccc3C#N)c3n2CCCC3)CC1
InChIInChI=1S/C22H25N5O2/c1-15-9-12-26(13-10-15)22(29)20-25-19(18-8-4-5-11-27(18)20)21(28)24-17-7-3-2-6-16(17)14-23/h2-3,6-7,15H,4-5,8-13H2,1H3,(H,24,28)
InChIKeyYMUAPZLHYBKGTI-UHFFFAOYSA-N
MW391.48 g/mol
LogP3.22
Rot. Bonds3

About N-(2-cyanophenyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide

N-(2-cyanophenyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 109074925) has the molecular formula C22H25N5O2 and a molecular weight of 391.48 g/mol. Its IUPAC name is N-(2-cyanophenyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
PubChem CID109074925
Molecular FormulaC22H25N5O2
Molecular Weight391.48 g/mol
Exact Mass391.20
IUPAC NameN-(2-cyanophenyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
SMILESCC1CCN(C(=O)c2nc(C(=O)Nc3ccccc3C#N)c3n2CCCC3)CC1
InChIInChI=1S/C22H25N5O2/c1-15-9-12-26(13-10-15)22(29)20-25-19(18-8-4-5-11-27(18)20)21(28)24-17-7-3-2-6-16(17)14-23/h2-3,6-7,15H,4-5,8-13H2,1H3,(H,24,28)
InChIKeyYMUAPZLHYBKGTI-UHFFFAOYSA-N
XLogP3.22
TPSA91.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.48
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,3-dimethylphenyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
CID 109074915
1-N-(2-cyanophenyl)-3-N-(2-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109077505
N-(2,5-dimethylphenyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
CID 109074911
1-N-(2-cyanophenyl)-3-N-(5-methyl-1,2-oxazol-3-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109077607
1-N-(2-cyanophenyl)-3-N-(3-methoxypropyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109075320
[3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]-pyrrolidin-1-ylmethanone
CID 109074080
[3-(azepane-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]-(4-methylpiperidin-1-yl)methanone
CID 109074845
(4-methylpiperidin-1-yl)-[3-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanone
CID 109074603
3-(azepane-1-carbonyl)-N-(2,3-dimethylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
CID 109077413
N-(3-methoxypropyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
CID 109074873
N-(3-acetylphenyl)-3-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
CID 109074303
1-(4-methylpiperidine-1-carbonyl)-N-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
CID 109072570

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-(2-cyanophenyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide (CID 109074925) is N-(2-cyanophenyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-(2-cyanophenyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-(2-cyanophenyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide is CC1CCN(C(=O)c2nc(C(=O)Nc3ccccc3C#N)c3n2CCCC3)CC1.
What is the InChIKey of N-(2-cyanophenyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is YMUAPZLHYBKGTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N5O2/c1-15-9-12-26(13-10-15)22(29)20-25-19(18-8-4-5-11-27(18)20)21(28)24-17-7-3-2-6-16(17)14-23/h2-3,6-7,15H,4-5,8-13H2,1H3,(H,24,28).
What are the key properties of N-(2-cyanophenyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
N-(2-cyanophenyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 391.48 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-3-(4-methylpiperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 109074925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).