N-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide

C15H15N3O3 — CID 31861747

IUPACN-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCn1ccc(C(=O)Nc2ccc(CC(N)=O)cc2)cc1=O
InChIInChI=1S/C15H15N3O3/c1-18-7-6-11(9-14(18)20)15(21)17-12-4-2-10(3-5-12)8-13(16)19/h2-7,9H,8H2,1H3,(H2,16,19)(H,17,21)
InChIKeyCRLVUUMNJOAEJQ-UHFFFAOYSA-N
MW285.30 g/mol
LogP0.67
Rot. Bonds4

About N-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide

N-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide (PubChem CID 31861747) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is N-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound NameN-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide
PubChem CID31861747
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC NameN-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCn1ccc(C(=O)Nc2ccc(CC(N)=O)cc2)cc1=O
InChIInChI=1S/C15H15N3O3/c1-18-7-6-11(9-14(18)20)15(21)17-12-4-2-10(3-5-12)8-13(16)19/h2-7,9H,8H2,1H3,(H2,16,19)(H,17,21)
InChIKeyCRLVUUMNJOAEJQ-UHFFFAOYSA-N
XLogP0.67
TPSA94.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide?
The IUPAC name of N-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide (CID 31861747) is N-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide.
What is the SMILES notation for N-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide?
The canonical SMILES for N-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide is Cn1ccc(C(=O)Nc2ccc(CC(N)=O)cc2)cc1=O.
What is the InChIKey of N-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide?
The InChIKey is CRLVUUMNJOAEJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3/c1-18-7-6-11(9-14(18)20)15(21)17-12-4-2-10(3-5-12)8-13(16)19/h2-7,9H,8H2,1H3,(H2,16,19)(H,17,21).
What are the key properties of N-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide?
N-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide has a molecular weight of 285.30 g/mol, XLogP of 0.67, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 31861747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).