N'-(3,4-dimethoxyphenyl)-N-phenyloxamide

C16H16N2O4 — CID 44999686

IUPACN'-(3,4-dimethoxyphenyl)-N-phenyloxamide
SMILESCOc1ccc(NC(=O)C(=O)Nc2ccccc2)cc1OC
InChIInChI=1S/C16H16N2O4/c1-21-13-9-8-12(10-14(13)22-2)18-16(20)15(19)17-11-6-4-3-5-7-11/h3-10H,1-2H3,(H,17,19)(H,18,20)
InChIKeyZSIHVIHYOCEHBY-UHFFFAOYSA-N
MW300.31 g/mol
LogP2.28
Rot. Bonds4

About N'-(3,4-dimethoxyphenyl)-N-phenyloxamide

N'-(3,4-dimethoxyphenyl)-N-phenyloxamide (PubChem CID 44999686) has the molecular formula C16H16N2O4 and a molecular weight of 300.31 g/mol. Its IUPAC name is N'-(3,4-dimethoxyphenyl)-N-phenyloxamide.

Molecular Properties

Compound NameN'-(3,4-dimethoxyphenyl)-N-phenyloxamide
PubChem CID44999686
Molecular FormulaC16H16N2O4
Molecular Weight300.31 g/mol
Exact Mass300.11
IUPAC NameN'-(3,4-dimethoxyphenyl)-N-phenyloxamide
SMILESCOc1ccc(NC(=O)C(=O)Nc2ccccc2)cc1OC
InChIInChI=1S/C16H16N2O4/c1-21-13-9-8-12(10-14(13)22-2)18-16(20)15(19)17-11-6-4-3-5-7-11/h3-10H,1-2H3,(H,17,19)(H,18,20)
InChIKeyZSIHVIHYOCEHBY-UHFFFAOYSA-N
XLogP2.28
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.31
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3,4-dimethoxyphenyl)-N'-(2-ethylphenyl)oxamide
CID 44999448
(3,4-dimethoxyphenyl)urea
CID 21197430
N'-(3,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide
CID 7585276
N,N'-bis(3,4-dimethoxyphenyl)propanediamide
CID 21232287
N'-(5-chloro-2-methoxyphenyl)-N-(3,4-dimethoxyphenyl)oxamide
CID 45000696
N-(2-aminoethyl)-N'-(3,4-dimethoxyphenyl)oxamide
CID 43315993
N-(3,4-dimethoxyphenyl)-2-hydroxybenzamide
CID 18105958
N-(4-carbamoylphenyl)-N'-(3-chloro-4-methoxyphenyl)oxamide
CID 108501263
N'-(3,4-dimethoxyphenyl)-N-(3-hydroxypropyl)oxamide
CID 5210710
2-amino-N-(3,4-dimethoxyphenyl)-2-phenylacetamide
CID 24703599
N'-(3,4-dimethoxyphenyl)-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]oxamide
CID 90598246
1-N',2-N'-bis(3,4-dimethoxyphenyl)ethanedihydrazide
CID 138619994

Frequently Asked Questions

What is the IUPAC name of N'-(3,4-dimethoxyphenyl)-N-phenyloxamide?
The IUPAC name of N'-(3,4-dimethoxyphenyl)-N-phenyloxamide (CID 44999686) is N'-(3,4-dimethoxyphenyl)-N-phenyloxamide.
What is the SMILES notation for N'-(3,4-dimethoxyphenyl)-N-phenyloxamide?
The canonical SMILES for N'-(3,4-dimethoxyphenyl)-N-phenyloxamide is COc1ccc(NC(=O)C(=O)Nc2ccccc2)cc1OC.
What is the InChIKey of N'-(3,4-dimethoxyphenyl)-N-phenyloxamide?
The InChIKey is ZSIHVIHYOCEHBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O4/c1-21-13-9-8-12(10-14(13)22-2)18-16(20)15(19)17-11-6-4-3-5-7-11/h3-10H,1-2H3,(H,17,19)(H,18,20).
What are the key properties of N'-(3,4-dimethoxyphenyl)-N-phenyloxamide?
N'-(3,4-dimethoxyphenyl)-N-phenyloxamide has a molecular weight of 300.31 g/mol, XLogP of 2.28, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3,4-dimethoxyphenyl)-N-phenyloxamide is sourced from PubChem (CID 44999686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).