N-methyl-6-oxo-N-[(2,3,4-trimethoxyphenyl)methyl]-1H-pyridine-3-carboxamide

C17H20N2O5 — CID 18113298

IUPACN-methyl-6-oxo-N-[(2,3,4-trimethoxyphenyl)methyl]-1H-pyridine-3-carboxamide
SMILESCOc1ccc(CN(C)C(=O)c2ccc(=O)[nH]c2)c(OC)c1OC
InChIInChI=1S/C17H20N2O5/c1-19(17(21)11-6-8-14(20)18-9-11)10-12-5-7-13(22-2)16(24-4)15(12)23-3/h5-9H,10H2,1-4H3,(H,18,20)
InChIKeyOYSXWNBTSHQWSC-UHFFFAOYSA-N
MW332.36 g/mol
LogP1.67
Rot. Bonds6

About N-methyl-6-oxo-N-[(2,3,4-trimethoxyphenyl)methyl]-1H-pyridine-3-carboxamide

N-methyl-6-oxo-N-[(2,3,4-trimethoxyphenyl)methyl]-1H-pyridine-3-carboxamide (PubChem CID 18113298) has the molecular formula C17H20N2O5 and a molecular weight of 332.36 g/mol. Its IUPAC name is N-methyl-6-oxo-N-[(2,3,4-trimethoxyphenyl)methyl]-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-oxo-N-[(2,3,4-trimethoxyphenyl)methyl]-1H-pyridine-3-carboxamide
PubChem CID18113298
Molecular FormulaC17H20N2O5
Molecular Weight332.36 g/mol
Exact Mass332.14
IUPAC NameN-methyl-6-oxo-N-[(2,3,4-trimethoxyphenyl)methyl]-1H-pyridine-3-carboxamide
SMILESCOc1ccc(CN(C)C(=O)c2ccc(=O)[nH]c2)c(OC)c1OC
InChIInChI=1S/C17H20N2O5/c1-19(17(21)11-6-8-14(20)18-9-11)10-12-5-7-13(22-2)16(24-4)15(12)23-3/h5-9H,10H2,1-4H3,(H,18,20)
InChIKeyOYSXWNBTSHQWSC-UHFFFAOYSA-N
XLogP1.67
TPSA80.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-methyl-6-oxo-N-[(2,3,4-trimethoxyphenyl)methyl]-1H-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,4-dimethyl-N-[(2,3,4-trimethoxyphenyl)methyl]benzamide
CID 17399115
N,2-dimethyl-N-[(2,3,4-trimethoxyphenyl)methyl]benzamide
CID 18113258
4-fluoro-N-[2-[methyl-[(2,3,4-trimethoxyphenyl)methyl]amino]-2-oxoethyl]benzamide
CID 18113370
N,3-dimethyl-N-[(2,3,4-trimethoxyphenyl)methyl]thiophene-2-carboxamide
CID 29358315
methyl 3-[methyl-(6-oxo-1H-pyridine-3-carbonyl)amino]propanoate
CID 54980402
2-ethoxy-N-methyl-N-[(2,3,4-trimethoxyphenyl)methyl]benzamide
CID 18113269
N-[(4-fluorophenyl)methyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide
CID 4803573
N-(1H-indol-3-ylmethyl)-3,4-dimethoxy-N-methylbenzamide
CID 110733002
4-acetyl-N-[(2,3-dimethoxyphenyl)methyl]-N-methyl-1H-pyrrole-2-carboxamide
CID 18112118
N-[(2,3-dimethoxyphenyl)methyl]-N,3,5-trimethylbenzamide
CID 7936275
N-[3-[methyl-[(2,3,4-trimethoxyphenyl)methyl]carbamoyl]phenyl]thiophene-2-carboxamide
CID 18113327
N-[[4-[(dimethylamino)methyl]phenyl]methyl]-2-(2,3,4-trimethoxyphenyl)acetamide
CID 8533572

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-oxo-N-[(2,3,4-trimethoxyphenyl)methyl]-1H-pyridine-3-carboxamide?
The IUPAC name of N-methyl-6-oxo-N-[(2,3,4-trimethoxyphenyl)methyl]-1H-pyridine-3-carboxamide (CID 18113298) is N-methyl-6-oxo-N-[(2,3,4-trimethoxyphenyl)methyl]-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-6-oxo-N-[(2,3,4-trimethoxyphenyl)methyl]-1H-pyridine-3-carboxamide?
The canonical SMILES for N-methyl-6-oxo-N-[(2,3,4-trimethoxyphenyl)methyl]-1H-pyridine-3-carboxamide is COc1ccc(CN(C)C(=O)c2ccc(=O)[nH]c2)c(OC)c1OC.
What is the InChIKey of N-methyl-6-oxo-N-[(2,3,4-trimethoxyphenyl)methyl]-1H-pyridine-3-carboxamide?
The InChIKey is OYSXWNBTSHQWSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O5/c1-19(17(21)11-6-8-14(20)18-9-11)10-12-5-7-13(22-2)16(24-4)15(12)23-3/h5-9H,10H2,1-4H3,(H,18,20).
What are the key properties of N-methyl-6-oxo-N-[(2,3,4-trimethoxyphenyl)methyl]-1H-pyridine-3-carboxamide?
N-methyl-6-oxo-N-[(2,3,4-trimethoxyphenyl)methyl]-1H-pyridine-3-carboxamide has a molecular weight of 332.36 g/mol, XLogP of 1.67, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-oxo-N-[(2,3,4-trimethoxyphenyl)methyl]-1H-pyridine-3-carboxamide is sourced from PubChem (CID 18113298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).