N-benzyl-N,1-dimethyl-2-oxopyridine-4-carboxamide

C15H16N2O2 — CID 35552246

IUPACN-benzyl-N,1-dimethyl-2-oxopyridine-4-carboxamide
SMILESCN(Cc1ccccc1)C(=O)c1ccn(C)c(=O)c1
InChIInChI=1S/C15H16N2O2/c1-16-9-8-13(10-14(16)18)15(19)17(2)11-12-6-4-3-5-7-12/h3-10H,11H2,1-2H3
InChIKeyTYKFLZUBMCMXQG-UHFFFAOYSA-N
MW256.31 g/mol
LogP1.66
Rot. Bonds3

About N-benzyl-N,1-dimethyl-2-oxopyridine-4-carboxamide

N-benzyl-N,1-dimethyl-2-oxopyridine-4-carboxamide (PubChem CID 35552246) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is N-benzyl-N,1-dimethyl-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound NameN-benzyl-N,1-dimethyl-2-oxopyridine-4-carboxamide
PubChem CID35552246
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC NameN-benzyl-N,1-dimethyl-2-oxopyridine-4-carboxamide
SMILESCN(Cc1ccccc1)C(=O)c1ccn(C)c(=O)c1
InChIInChI=1S/C15H16N2O2/c1-16-9-8-13(10-14(16)18)15(19)17(2)11-12-6-4-3-5-7-12/h3-10H,11H2,1-2H3
InChIKeyTYKFLZUBMCMXQG-UHFFFAOYSA-N
XLogP1.66
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N,1-dimethyl-2-oxopyridine-4-carboxamide?
The IUPAC name of N-benzyl-N,1-dimethyl-2-oxopyridine-4-carboxamide (CID 35552246) is N-benzyl-N,1-dimethyl-2-oxopyridine-4-carboxamide.
What is the SMILES notation for N-benzyl-N,1-dimethyl-2-oxopyridine-4-carboxamide?
The canonical SMILES for N-benzyl-N,1-dimethyl-2-oxopyridine-4-carboxamide is CN(Cc1ccccc1)C(=O)c1ccn(C)c(=O)c1.
What is the InChIKey of N-benzyl-N,1-dimethyl-2-oxopyridine-4-carboxamide?
The InChIKey is TYKFLZUBMCMXQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-16-9-8-13(10-14(16)18)15(19)17(2)11-12-6-4-3-5-7-12/h3-10H,11H2,1-2H3.
What are the key properties of N-benzyl-N,1-dimethyl-2-oxopyridine-4-carboxamide?
N-benzyl-N,1-dimethyl-2-oxopyridine-4-carboxamide has a molecular weight of 256.31 g/mol, XLogP of 1.66, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N,1-dimethyl-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 35552246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).