5-N-ethyl-3-N-[(3-methoxyphenyl)methyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide

C18H21N3O4 — CID 126749858

IUPAC5-N-ethyl-3-N-[(3-methoxyphenyl)methyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide
SMILESCCNC(=O)c1c[nH]c(=O)c(C(=O)N(C)Cc2cccc(OC)c2)c1
InChIInChI=1S/C18H21N3O4/c1-4-19-16(22)13-9-15(17(23)20-10-13)18(24)21(2)11-12-6-5-7-14(8-12)25-3/h5-10H,4,11H2,1-3H3,(H,19,22)(H,20,23)
InChIKeyHZZXAVLNINOASU-UHFFFAOYSA-N
MW343.38 g/mol
LogP1.41
Rot. Bonds6

About 5-N-ethyl-3-N-[(3-methoxyphenyl)methyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide

5-N-ethyl-3-N-[(3-methoxyphenyl)methyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide (PubChem CID 126749858) has the molecular formula C18H21N3O4 and a molecular weight of 343.38 g/mol. Its IUPAC name is 5-N-ethyl-3-N-[(3-methoxyphenyl)methyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-ethyl-3-N-[(3-methoxyphenyl)methyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide
PubChem CID126749858
Molecular FormulaC18H21N3O4
Molecular Weight343.38 g/mol
Exact Mass343.15
IUPAC Name5-N-ethyl-3-N-[(3-methoxyphenyl)methyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide
SMILESCCNC(=O)c1c[nH]c(=O)c(C(=O)N(C)Cc2cccc(OC)c2)c1
InChIInChI=1S/C18H21N3O4/c1-4-19-16(22)13-9-15(17(23)20-10-13)18(24)21(2)11-12-6-5-7-14(8-12)25-3/h5-10H,4,11H2,1-3H3,(H,19,22)(H,20,23)
InChIKeyHZZXAVLNINOASU-UHFFFAOYSA-N
XLogP1.41
TPSA91.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-N-ethyl-3-N-[(3-methoxyphenyl)methyl]-3-N-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

5-N-ethyl-3-N-[[3-(2-hydroxyethoxy)phenyl]methyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide
CID 126749880
3-methoxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide
CID 22070414
3-ethyl-1-[(3-methoxyphenyl)methyl]-1-methylthiourea
CID 8768028
2,5-dihydroxy-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide
CID 107722488
5-amino-N-[(3-methoxyphenyl)methyl]-N-methyl-1H-pyrazole-4-carboxamide
CID 61418056
2,5-dibromo-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide
CID 114371373
3-N-benzyl-5-N-[2-(hydroxymethyl)cyclopropyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide
CID 126648395
3-bromo-2-chloro-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide
CID 103975419
5-bromo-N-methyl-N-[(3-methylphenyl)methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 126648643
ethyl N-[(3-methoxyphenyl)methyl]-N-methylcarbamate
CID 60636271
2-bromo-5-fluoro-N-[(3-methoxyphenyl)methyl]-N-methylbenzamide
CID 60667390
N-[(3-methoxyphenyl)methyl]-N-methyl-1H-indole-2-carboxamide
CID 29217686

Frequently Asked Questions

What is the IUPAC name of 5-N-ethyl-3-N-[(3-methoxyphenyl)methyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-ethyl-3-N-[(3-methoxyphenyl)methyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide (CID 126749858) is 5-N-ethyl-3-N-[(3-methoxyphenyl)methyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-ethyl-3-N-[(3-methoxyphenyl)methyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-ethyl-3-N-[(3-methoxyphenyl)methyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide is CCNC(=O)c1c[nH]c(=O)c(C(=O)N(C)Cc2cccc(OC)c2)c1.
What is the InChIKey of 5-N-ethyl-3-N-[(3-methoxyphenyl)methyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide?
The InChIKey is HZZXAVLNINOASU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O4/c1-4-19-16(22)13-9-15(17(23)20-10-13)18(24)21(2)11-12-6-5-7-14(8-12)25-3/h5-10H,4,11H2,1-3H3,(H,19,22)(H,20,23).
What are the key properties of 5-N-ethyl-3-N-[(3-methoxyphenyl)methyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide?
5-N-ethyl-3-N-[(3-methoxyphenyl)methyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide has a molecular weight of 343.38 g/mol, XLogP of 1.41, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-ethyl-3-N-[(3-methoxyphenyl)methyl]-3-N-methyl-2-oxo-1H-pyridine-3,5-dicarboxamide is sourced from PubChem (CID 126749858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).