N-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide

C15H15N3O2 — CID 110705464

IUPACN-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)CNC(=O)c2cccnc2)cc1
InChIInChI=1S/C15H15N3O2/c1-11-4-6-13(7-5-11)18-14(19)10-17-15(20)12-3-2-8-16-9-12/h2-9H,10H2,1H3,(H,17,20)(H,18,19)
InChIKeyJPXOPVFKVGYIRQ-UHFFFAOYSA-N
MW269.30 g/mol
LogP1.76
Rot. Bonds4

About N-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide

N-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide (PubChem CID 110705464) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is N-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide
PubChem CID110705464
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC NameN-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)CNC(=O)c2cccnc2)cc1
InChIInChI=1S/C15H15N3O2/c1-11-4-6-13(7-5-11)18-14(19)10-17-15(20)12-3-2-8-16-9-12/h2-9H,10H2,1H3,(H,17,20)(H,18,19)
InChIKeyJPXOPVFKVGYIRQ-UHFFFAOYSA-N
XLogP1.76
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]pyridine-3-carboxamide
CID 110705497
N-[2-(3-acetylanilino)-2-oxoethyl]pyridine-3-carboxamide
CID 110705505
N-[2-(2,4-dimethylanilino)-2-oxoethyl]pyridine-3-carboxamide
CID 110705466
N-[2-(3-bromoanilino)-2-oxoethyl]pyridine-3-carboxamide
CID 110705521
N-(2-hydrazinyl-2-oxoethyl)pyridine-3-carboxamide
CID 39070404
N-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]pyridine-3-carboxamide
CID 84505135
N-[2-[4-(1-bicyclo[1.1.1]pentanylamino)sulfanylanilino]-2-oxoethyl]pyridine-3-carboxamide
CID 156652794
N-[2-[(2-benzamidoacetyl)amino]phenyl]pyridine-3-carboxamide
CID 108925269
N-(2-anilino-2-oxoethyl)-4-methylbenzamide
CID 4010991
N-(4-acetamidophenyl)pyridine-3-carboxamide
CID 766053
N-[2-oxo-2-[[(1S)-1-pyridin-3-ylethyl]amino]ethyl]pyridine-3-carboxamide
CID 166223531
4-chloro-N-[2-(4-methylanilino)-2-oxoethyl]benzamide
CID 2989490

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide?
The IUPAC name of N-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide (CID 110705464) is N-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide?
The canonical SMILES for N-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide is Cc1ccc(NC(=O)CNC(=O)c2cccnc2)cc1.
What is the InChIKey of N-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide?
The InChIKey is JPXOPVFKVGYIRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-11-4-6-13(7-5-11)18-14(19)10-17-15(20)12-3-2-8-16-9-12/h2-9H,10H2,1H3,(H,17,20)(H,18,19).
What are the key properties of N-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide?
N-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide has a molecular weight of 269.30 g/mol, XLogP of 1.76, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide is sourced from PubChem (CID 110705464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).