N-benzyl-2,3-dimethylpyridine-4-carboxamide

C15H16N2O — CID 110850641

IUPACN-benzyl-2,3-dimethylpyridine-4-carboxamide
SMILESCc1nccc(C(=O)NCc2ccccc2)c1C
InChIInChI=1S/C15H16N2O/c1-11-12(2)16-9-8-14(11)15(18)17-10-13-6-4-3-5-7-13/h3-9H,10H2,1-2H3,(H,17,18)
InChIKeyYALUXUXZSIIITH-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.63
Rot. Bonds3

About N-benzyl-2,3-dimethylpyridine-4-carboxamide

N-benzyl-2,3-dimethylpyridine-4-carboxamide (PubChem CID 110850641) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is N-benzyl-2,3-dimethylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-benzyl-2,3-dimethylpyridine-4-carboxamide
PubChem CID110850641
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC NameN-benzyl-2,3-dimethylpyridine-4-carboxamide
SMILESCc1nccc(C(=O)NCc2ccccc2)c1C
InChIInChI=1S/C15H16N2O/c1-11-12(2)16-9-8-14(11)15(18)17-10-13-6-4-3-5-7-13/h3-9H,10H2,1-2H3,(H,17,18)
InChIKeyYALUXUXZSIIITH-UHFFFAOYSA-N
XLogP2.63
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4-fluorophenyl)methyl]-2,3-dimethylpyridine-4-carboxamide
CID 110851337
N-benzyl-2,4-dimethylpyrimidine-5-carboxamide
CID 53007173
2-amino-N-benzyl-4-methylpyrimidine-5-carboxamide
CID 1487920
5-amino-N-benzyl-2-methylpyridine-3-carboxamide
CID 54917003
N-[2-(4-chlorophenyl)ethyl]-2,3-dimethylpyridine-4-carboxamide
CID 110853490
N-[(4-bromophenyl)methyl]-2-methylpyridine-3-carboxamide
CID 78950948
N,2,3-trimethyl-N-phenylpyridine-4-carboxamide
CID 110856944
N-benzyl-2-methyl-3-nitrobenzamide
CID 710984
1-N,2-N,3-N-tribenzylbenzene-1,2,3-tricarboxamide
CID 70015173
4-methyl-2-phenyl-N-(pyridin-4-ylmethyl)pyrimidine-5-carboxamide
CID 110852258
2-N-benzyl-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109085391
N-benzyl-5-methyl-1H-imidazole-4-carboxamide
CID 71320720

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2,3-dimethylpyridine-4-carboxamide?
The IUPAC name of N-benzyl-2,3-dimethylpyridine-4-carboxamide (CID 110850641) is N-benzyl-2,3-dimethylpyridine-4-carboxamide.
What is the SMILES notation for N-benzyl-2,3-dimethylpyridine-4-carboxamide?
The canonical SMILES for N-benzyl-2,3-dimethylpyridine-4-carboxamide is Cc1nccc(C(=O)NCc2ccccc2)c1C.
What is the InChIKey of N-benzyl-2,3-dimethylpyridine-4-carboxamide?
The InChIKey is YALUXUXZSIIITH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c1-11-12(2)16-9-8-14(11)15(18)17-10-13-6-4-3-5-7-13/h3-9H,10H2,1-2H3,(H,17,18).
What are the key properties of N-benzyl-2,3-dimethylpyridine-4-carboxamide?
N-benzyl-2,3-dimethylpyridine-4-carboxamide has a molecular weight of 240.31 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2,3-dimethylpyridine-4-carboxamide is sourced from PubChem (CID 110850641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).