N-(3,4-diethoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide

C18H21N3O4 — CID 108519873

IUPACN-(3,4-diethoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide
SMILESCCOc1ccc(NC(=O)C(=O)Nc2cccc(C)n2)cc1OCC
InChIInChI=1S/C18H21N3O4/c1-4-24-14-10-9-13(11-15(14)25-5-2)20-17(22)18(23)21-16-8-6-7-12(3)19-16/h6-11H,4-5H2,1-3H3,(H,20,22)(H,19,21,23)
InChIKeyFZOAZJODRYYLTB-UHFFFAOYSA-N
MW343.38 g/mol
LogP2.76
Rot. Bonds6

About N-(3,4-diethoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide

N-(3,4-diethoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide (PubChem CID 108519873) has the molecular formula C18H21N3O4 and a molecular weight of 343.38 g/mol. Its IUPAC name is N-(3,4-diethoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide.

Molecular Properties

Compound NameN-(3,4-diethoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide
PubChem CID108519873
Molecular FormulaC18H21N3O4
Molecular Weight343.38 g/mol
Exact Mass343.15
IUPAC NameN-(3,4-diethoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide
SMILESCCOc1ccc(NC(=O)C(=O)Nc2cccc(C)n2)cc1OCC
InChIInChI=1S/C18H21N3O4/c1-4-24-14-10-9-13(11-15(14)25-5-2)20-17(22)18(23)21-16-8-6-7-12(3)19-16/h6-11H,4-5H2,1-3H3,(H,20,22)(H,19,21,23)
InChIKeyFZOAZJODRYYLTB-UHFFFAOYSA-N
XLogP2.76
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze N-(3,4-diethoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide 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'-tert-butyl-N-(3,4-diethoxyphenyl)oxamide
CID 108506834
N-(3,4-diethoxyphenyl)acetamide
CID 13120229
ethyl N-(6-methyl-2-pyridinyl)carbamate
CID 5197559
N-(4-carbamoylphenyl)-N'-(6-methyl-2-pyridinyl)oxamide
CID 108525732
N-(3,4-diethoxyphenyl)-2-(methylamino)acetamide
CID 2452186
N'-tert-butyl-N-(6-methyl-2-pyridinyl)oxamide
CID 44997660
(Z)-2-cyano-3-(3,4-diethoxyanilino)-N-(3-methylphenyl)prop-2-enamide
CID 108858599
N-[3-(aminomethyl)-4-ethoxyphenyl]-6-methylpyridine-2-carboxamide
CID 63755297
5-[(4-amino-2,5-diethoxyphenyl)methylcarbamoylamino]-2-ethoxy-N-(6-methyl-2-pyridinyl)benzamide
CID 141452215
N-(3,4-diethoxyphenyl)pyridine-2-carboxamide
CID 17411866
N-(3,4-diethoxyphenyl)-2-methylbenzamide
CID 26212680
N-(3,4-diethoxyphenyl)-2,6-difluorobenzamide
CID 26212684

Frequently Asked Questions

What is the IUPAC name of N-(3,4-diethoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide?
The IUPAC name of N-(3,4-diethoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide (CID 108519873) is N-(3,4-diethoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide.
What is the SMILES notation for N-(3,4-diethoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide?
The canonical SMILES for N-(3,4-diethoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide is CCOc1ccc(NC(=O)C(=O)Nc2cccc(C)n2)cc1OCC.
What is the InChIKey of N-(3,4-diethoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide?
The InChIKey is FZOAZJODRYYLTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O4/c1-4-24-14-10-9-13(11-15(14)25-5-2)20-17(22)18(23)21-16-8-6-7-12(3)19-16/h6-11H,4-5H2,1-3H3,(H,20,22)(H,19,21,23).
What are the key properties of N-(3,4-diethoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide?
N-(3,4-diethoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide has a molecular weight of 343.38 g/mol, XLogP of 2.76, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-diethoxyphenyl)-N'-(6-methyl-2-pyridinyl)oxamide is sourced from PubChem (CID 108519873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).