N'-(3-acetamidophenyl)-N-(3-chlorophenyl)oxamide

C16H14ClN3O3 — CID 108516501

IUPACN'-(3-acetamidophenyl)-N-(3-chlorophenyl)oxamide
SMILESCC(=O)Nc1cccc(NC(=O)C(=O)Nc2cccc(Cl)c2)c1
InChIInChI=1S/C16H14ClN3O3/c1-10(21)18-13-6-3-7-14(9-13)20-16(23)15(22)19-12-5-2-4-11(17)8-12/h2-9H,1H3,(H,18,21)(H,19,22)(H,20,23)
InChIKeyICPAJDYEQWAQKO-UHFFFAOYSA-N
MW331.76 g/mol
LogP2.88
Rot. Bonds3

About N'-(3-acetamidophenyl)-N-(3-chlorophenyl)oxamide

N'-(3-acetamidophenyl)-N-(3-chlorophenyl)oxamide (PubChem CID 108516501) has the molecular formula C16H14ClN3O3 and a molecular weight of 331.76 g/mol. Its IUPAC name is N'-(3-acetamidophenyl)-N-(3-chlorophenyl)oxamide.

Molecular Properties

Compound NameN'-(3-acetamidophenyl)-N-(3-chlorophenyl)oxamide
PubChem CID108516501
Molecular FormulaC16H14ClN3O3
Molecular Weight331.76 g/mol
Exact Mass331.07
IUPAC NameN'-(3-acetamidophenyl)-N-(3-chlorophenyl)oxamide
SMILESCC(=O)Nc1cccc(NC(=O)C(=O)Nc2cccc(Cl)c2)c1
InChIInChI=1S/C16H14ClN3O3/c1-10(21)18-13-6-3-7-14(9-13)20-16(23)15(22)19-12-5-2-4-11(17)8-12/h2-9H,1H3,(H,18,21)(H,19,22)(H,20,23)
InChIKeyICPAJDYEQWAQKO-UHFFFAOYSA-N
XLogP2.88
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.76
LogP ≤ 52.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-chlorophenyl)acetamide;N-phenylacetamide
CID 160915382
N-(3-chlorophenyl)-N'-(3,5-dichlorophenyl)oxamide
CID 108516544
N-(3-acetamidophenyl)-N'-(2,5-dichlorophenyl)oxamide
CID 108501018
N'-(3-acetamidophenyl)-N-phenyloxamide
CID 45001278
N-(3-acetamidophenyl)-3-chlorobenzamide
CID 669190
N'-(3-chlorophenyl)-N-(4-propan-2-ylphenyl)oxamide
CID 44996296
N'-(3-chlorophenyl)-N-[3-(dimethylamino)phenyl]oxamide
CID 108516523
N'-(3-acetamidophenyl)-N-[(4-chlorophenyl)methyl]oxamide
CID 7584730
N-(3-acetamidophenyl)-N'-(3,5-dichlorophenyl)propanediamide
CID 108956248
N-(3-chlorophenyl)-N'-(3,4,5-trimethoxyphenyl)oxamide
CID 108987070
N-(3-chlorophenyl)-N'-(1-phenylethylideneamino)oxamide
CID 4249349
methyl N-(3-chlorophenyl)carbamate
CID 16529

Frequently Asked Questions

What is the IUPAC name of N'-(3-acetamidophenyl)-N-(3-chlorophenyl)oxamide?
The IUPAC name of N'-(3-acetamidophenyl)-N-(3-chlorophenyl)oxamide (CID 108516501) is N'-(3-acetamidophenyl)-N-(3-chlorophenyl)oxamide.
What is the SMILES notation for N'-(3-acetamidophenyl)-N-(3-chlorophenyl)oxamide?
The canonical SMILES for N'-(3-acetamidophenyl)-N-(3-chlorophenyl)oxamide is CC(=O)Nc1cccc(NC(=O)C(=O)Nc2cccc(Cl)c2)c1.
What is the InChIKey of N'-(3-acetamidophenyl)-N-(3-chlorophenyl)oxamide?
The InChIKey is ICPAJDYEQWAQKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClN3O3/c1-10(21)18-13-6-3-7-14(9-13)20-16(23)15(22)19-12-5-2-4-11(17)8-12/h2-9H,1H3,(H,18,21)(H,19,22)(H,20,23).
What are the key properties of N'-(3-acetamidophenyl)-N-(3-chlorophenyl)oxamide?
N'-(3-acetamidophenyl)-N-(3-chlorophenyl)oxamide has a molecular weight of 331.76 g/mol, XLogP of 2.88, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-acetamidophenyl)-N-(3-chlorophenyl)oxamide is sourced from PubChem (CID 108516501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).