N-[(4-cyanophenyl)methyl]-2-methylimidazo[1,2-a]pyridine-5-carboxamide

C17H14N4O — CID 143894583

IUPACN-[(4-cyanophenyl)methyl]-2-methylimidazo[1,2-a]pyridine-5-carboxamide
SMILESCc1cn2c(C(=O)NCc3ccc(C#N)cc3)cccc2n1
InChIInChI=1S/C17H14N4O/c1-12-11-21-15(3-2-4-16(21)20-12)17(22)19-10-14-7-5-13(9-18)6-8-14/h2-8,11H,10H2,1H3,(H,19,22)
InChIKeyUBNPPPRSCNRNTP-UHFFFAOYSA-N
MW290.33 g/mol
LogP2.44
Rot. Bonds3

About N-[(4-cyanophenyl)methyl]-2-methylimidazo[1,2-a]pyridine-5-carboxamide

N-[(4-cyanophenyl)methyl]-2-methylimidazo[1,2-a]pyridine-5-carboxamide (PubChem CID 143894583) has the molecular formula C17H14N4O and a molecular weight of 290.33 g/mol. Its IUPAC name is N-[(4-cyanophenyl)methyl]-2-methylimidazo[1,2-a]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-[(4-cyanophenyl)methyl]-2-methylimidazo[1,2-a]pyridine-5-carboxamide
PubChem CID143894583
Molecular FormulaC17H14N4O
Molecular Weight290.33 g/mol
Exact Mass290.12
IUPAC NameN-[(4-cyanophenyl)methyl]-2-methylimidazo[1,2-a]pyridine-5-carboxamide
SMILESCc1cn2c(C(=O)NCc3ccc(C#N)cc3)cccc2n1
InChIInChI=1S/C17H14N4O/c1-12-11-21-15(3-2-4-16(21)20-12)17(22)19-10-14-7-5-13(9-18)6-8-14/h2-8,11H,10H2,1H3,(H,19,22)
InChIKeyUBNPPPRSCNRNTP-UHFFFAOYSA-N
XLogP2.44
TPSA70.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-cyanophenyl)methyl]-2,6-dimethylpyridine-3-carboxamide
CID 47283449
N-[(4-cyanophenyl)methyl]-2-methylpyridine-3-carboxamide
CID 78951088
3-chloro-N-[(4-cyanophenyl)methyl]-2-methylbenzamide
CID 107096765
N-[(4-cyanophenyl)methyl]-1-methylpyrazole-4-carboxamide
CID 47161871
4-acetyl-N-[(4-cyanophenyl)methyl]-1-ethylpyrrole-2-carboxamide
CID 171483210
N-[(4-methoxyphenyl)methyl]imidazo[1,2-a]pyridine-5-carboxamide
CID 110851649
2-(4-cyanophenyl)-N-[(4-methylphenyl)methyl]acetamide
CID 62403486
N-[(4-cyanophenyl)methyl]-4,5-dimethylthiophene-2-carboxamide
CID 60736885
5-N-[(3-aminophenyl)methyl]-2-N-[(4-fluoro-3-methylphenyl)methyl]imidazo[1,2-a]pyridine-2,5-dicarboxamide
CID 70245525
N-[(4-cyanophenyl)methyl]-2,6-dimethylquinoline-4-carboxamide
CID 134035263
N-[(4-cyanophenyl)methyl]-4-fluoro-3-methyl-1-benzothiophene-2-carboxamide
CID 134035410
N-benzyl-4-cyano(111C)cyclohexa-1,3,5-triene-1-carboxamide
CID 177456736

Frequently Asked Questions

What is the IUPAC name of N-[(4-cyanophenyl)methyl]-2-methylimidazo[1,2-a]pyridine-5-carboxamide?
The IUPAC name of N-[(4-cyanophenyl)methyl]-2-methylimidazo[1,2-a]pyridine-5-carboxamide (CID 143894583) is N-[(4-cyanophenyl)methyl]-2-methylimidazo[1,2-a]pyridine-5-carboxamide.
What is the SMILES notation for N-[(4-cyanophenyl)methyl]-2-methylimidazo[1,2-a]pyridine-5-carboxamide?
The canonical SMILES for N-[(4-cyanophenyl)methyl]-2-methylimidazo[1,2-a]pyridine-5-carboxamide is Cc1cn2c(C(=O)NCc3ccc(C#N)cc3)cccc2n1.
What is the InChIKey of N-[(4-cyanophenyl)methyl]-2-methylimidazo[1,2-a]pyridine-5-carboxamide?
The InChIKey is UBNPPPRSCNRNTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O/c1-12-11-21-15(3-2-4-16(21)20-12)17(22)19-10-14-7-5-13(9-18)6-8-14/h2-8,11H,10H2,1H3,(H,19,22).
What are the key properties of N-[(4-cyanophenyl)methyl]-2-methylimidazo[1,2-a]pyridine-5-carboxamide?
N-[(4-cyanophenyl)methyl]-2-methylimidazo[1,2-a]pyridine-5-carboxamide has a molecular weight of 290.33 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-cyanophenyl)methyl]-2-methylimidazo[1,2-a]pyridine-5-carboxamide is sourced from PubChem (CID 143894583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).