N-(3-cyanophenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide

C20H17N5O2 — CID 109068018

IUPACN-(3-cyanophenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESN#Cc1cccc(NC(=O)c2nc(C(=O)N3CCCC3)c3ccccn23)c1
InChIInChI=1S/C20H17N5O2/c21-13-14-6-5-7-15(12-14)22-19(26)18-23-17(16-8-1-2-11-25(16)18)20(27)24-9-3-4-10-24/h1-2,5-8,11-12H,3-4,9-10H2,(H,22,26)
InChIKeyNWHHQLWNJIOCKU-UHFFFAOYSA-N
MW359.39 g/mol
LogP2.69
Rot. Bonds3

About N-(3-cyanophenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide

N-(3-cyanophenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide (PubChem CID 109068018) has the molecular formula C20H17N5O2 and a molecular weight of 359.39 g/mol. Its IUPAC name is N-(3-cyanophenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-cyanophenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
PubChem CID109068018
Molecular FormulaC20H17N5O2
Molecular Weight359.39 g/mol
Exact Mass359.14
IUPAC NameN-(3-cyanophenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESN#Cc1cccc(NC(=O)c2nc(C(=O)N3CCCC3)c3ccccn23)c1
InChIInChI=1S/C20H17N5O2/c21-13-14-6-5-7-15(12-14)22-19(26)18-23-17(16-8-1-2-11-25(16)18)20(27)24-9-3-4-10-24/h1-2,5-8,11-12H,3-4,9-10H2,(H,22,26)
InChIKeyNWHHQLWNJIOCKU-UHFFFAOYSA-N
XLogP2.69
TPSA90.50 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.39
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-cyanophenyl)-3-(4-methylpiperidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109068818
N-(3,4-dimethylphenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109067964
N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109068010
1-N-(3-cyanophenyl)-3-N-pentylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109071458
1-(4-methylpiperidine-1-carbonyl)-N-phenylimidazo[1,5-a]pyridine-3-carboxamide
CID 109068726
N-(3-methoxyphenyl)-1-(morpholine-4-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109069342
N-(5-methyl-1,2-oxazol-3-yl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 109068024
N-(3-cyanophenyl)-1-(morpholine-4-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
CID 109075405
1-(piperidine-1-carbonyl)-N-propan-2-ylimidazo[1,5-a]pyridine-3-carboxamide
CID 109066328
1-(azepane-1-carbonyl)-N-cycloheptylimidazo[1,5-a]pyridine-3-carboxamide
CID 109071234
1-[4-[3-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-1-carbonyl]piperazin-1-yl]ethanone
CID 109068040
1-(piperidine-1-carbonyl)-N-prop-2-enylimidazo[1,5-a]pyridine-3-carboxamide
CID 109066963

Frequently Asked Questions

What is the IUPAC name of N-(3-cyanophenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-(3-cyanophenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide (CID 109068018) is N-(3-cyanophenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-(3-cyanophenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-(3-cyanophenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide is N#Cc1cccc(NC(=O)c2nc(C(=O)N3CCCC3)c3ccccn23)c1.
What is the InChIKey of N-(3-cyanophenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
The InChIKey is NWHHQLWNJIOCKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N5O2/c21-13-14-6-5-7-15(12-14)22-19(26)18-23-17(16-8-1-2-11-25(16)18)20(27)24-9-3-4-10-24/h1-2,5-8,11-12H,3-4,9-10H2,(H,22,26).
What are the key properties of N-(3-cyanophenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide?
N-(3-cyanophenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide has a molecular weight of 359.39 g/mol, XLogP of 2.69, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyanophenyl)-1-(pyrrolidine-1-carbonyl)imidazo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 109068018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).