5-N-cyclopropyl-3-N-methyl-3-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3,5-dicarboxamide

C19H21N3O3 — CID 126648564

IUPAC5-N-cyclopropyl-3-N-methyl-3-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3,5-dicarboxamide
SMILESCc1ccc(CN(C)C(=O)c2cc(C(=O)NC3CC3)c[nH]c2=O)cc1
InChIInChI=1S/C19H21N3O3/c1-12-3-5-13(6-4-12)11-22(2)19(25)16-9-14(10-20-18(16)24)17(23)21-15-7-8-15/h3-6,9-10,15H,7-8,11H2,1-2H3,(H,20,24)(H,21,23)
InChIKeyXUCFKDQPTGYLCR-UHFFFAOYSA-N
MW339.40 g/mol
LogP1.85
Rot. Bonds5

About 5-N-cyclopropyl-3-N-methyl-3-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3,5-dicarboxamide

5-N-cyclopropyl-3-N-methyl-3-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3,5-dicarboxamide (PubChem CID 126648564) has the molecular formula C19H21N3O3 and a molecular weight of 339.40 g/mol. Its IUPAC name is 5-N-cyclopropyl-3-N-methyl-3-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-cyclopropyl-3-N-methyl-3-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3,5-dicarboxamide
PubChem CID126648564
Molecular FormulaC19H21N3O3
Molecular Weight339.40 g/mol
Exact Mass339.16
IUPAC Name5-N-cyclopropyl-3-N-methyl-3-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3,5-dicarboxamide
SMILESCc1ccc(CN(C)C(=O)c2cc(C(=O)NC3CC3)c[nH]c2=O)cc1
InChIInChI=1S/C19H21N3O3/c1-12-3-5-13(6-4-12)11-22(2)19(25)16-9-14(10-20-18(16)24)17(23)21-15-7-8-15/h3-6,9-10,15H,7-8,11H2,1-2H3,(H,20,24)(H,21,23)
InChIKeyXUCFKDQPTGYLCR-UHFFFAOYSA-N
XLogP1.85
TPSA82.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-N-cyclopropyl-3-N-methyl-3-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3,5-dicarboxamide 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

3-N-benzyl-5-N-[2-(hydroxymethyl)cyclopropyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide
CID 126648395
N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-N,2,3-trimethylbenzamide
CID 38398694
3-N-benzyl-3-N-methyl-2-oxo-5-N-(3,3,3-trifluoropropyl)-1H-pyridine-3,5-dicarboxamide
CID 126749840
N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-5-(diethylsulfamoyl)-N,2-dimethylbenzamide
CID 38394548
5-(cyclopropylsulfamoyl)-N,2-dimethyl-N-[(4-methylphenyl)methyl]benzamide
CID 18170187
N-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide
CID 103762664
4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide
CID 43393996
1-N-cyclopropyl-4-N-[(3,4-dimethoxyphenyl)methyl]-4-N-methylbenzene-1,4-dicarboxamide
CID 178070560
N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-2,3-diethyl-N-methylquinoxaline-6-carboxamide
CID 30797400
N-methyl-N-[(4-methylphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
CID 154858407
5-bromo-N-methyl-N-[(3-methylphenyl)methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 126648643
3,5-dichloro-N-[4-[[4-(cyclopropylcarbamoyl)phenyl]methyl-methylcarbamoyl]phenyl]benzamide
CID 37344285

Frequently Asked Questions

What is the IUPAC name of 5-N-cyclopropyl-3-N-methyl-3-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-cyclopropyl-3-N-methyl-3-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3,5-dicarboxamide (CID 126648564) is 5-N-cyclopropyl-3-N-methyl-3-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-cyclopropyl-3-N-methyl-3-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-cyclopropyl-3-N-methyl-3-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3,5-dicarboxamide is Cc1ccc(CN(C)C(=O)c2cc(C(=O)NC3CC3)c[nH]c2=O)cc1.
What is the InChIKey of 5-N-cyclopropyl-3-N-methyl-3-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3,5-dicarboxamide?
The InChIKey is XUCFKDQPTGYLCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3/c1-12-3-5-13(6-4-12)11-22(2)19(25)16-9-14(10-20-18(16)24)17(23)21-15-7-8-15/h3-6,9-10,15H,7-8,11H2,1-2H3,(H,20,24)(H,21,23).
What are the key properties of 5-N-cyclopropyl-3-N-methyl-3-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3,5-dicarboxamide?
5-N-cyclopropyl-3-N-methyl-3-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3,5-dicarboxamide has a molecular weight of 339.40 g/mol, XLogP of 1.85, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-cyclopropyl-3-N-methyl-3-N-[(4-methylphenyl)methyl]-2-oxo-1H-pyridine-3,5-dicarboxamide is sourced from PubChem (CID 126648564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).