N-(3-acetamidophenyl)-N'-(2,5-dichlorophenyl)oxamide

C16H13Cl2N3O3 — CID 108501018

IUPACN-(3-acetamidophenyl)-N'-(2,5-dichlorophenyl)oxamide
SMILESCC(=O)Nc1cccc(NC(=O)C(=O)Nc2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C16H13Cl2N3O3/c1-9(22)19-11-3-2-4-12(8-11)20-15(23)16(24)21-14-7-10(17)5-6-13(14)18/h2-8H,1H3,(H,19,22)(H,20,23)(H,21,24)
InChIKeyFLUYLFLNUWPOQS-UHFFFAOYSA-N
MW366.20 g/mol
LogP3.53
Rot. Bonds3

About N-(3-acetamidophenyl)-N'-(2,5-dichlorophenyl)oxamide

N-(3-acetamidophenyl)-N'-(2,5-dichlorophenyl)oxamide (PubChem CID 108501018) has the molecular formula C16H13Cl2N3O3 and a molecular weight of 366.20 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-N'-(2,5-dichlorophenyl)oxamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-N'-(2,5-dichlorophenyl)oxamide
PubChem CID108501018
Molecular FormulaC16H13Cl2N3O3
Molecular Weight366.20 g/mol
Exact Mass365.03
IUPAC NameN-(3-acetamidophenyl)-N'-(2,5-dichlorophenyl)oxamide
SMILESCC(=O)Nc1cccc(NC(=O)C(=O)Nc2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C16H13Cl2N3O3/c1-9(22)19-11-3-2-4-12(8-11)20-15(23)16(24)21-14-7-10(17)5-6-13(14)18/h2-8H,1H3,(H,19,22)(H,20,23)(H,21,24)
InChIKeyFLUYLFLNUWPOQS-UHFFFAOYSA-N
XLogP3.53
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.20
LogP ≤ 53.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-N'-(2,5-dichlorophenyl)oxamide?
The IUPAC name of N-(3-acetamidophenyl)-N'-(2,5-dichlorophenyl)oxamide (CID 108501018) is N-(3-acetamidophenyl)-N'-(2,5-dichlorophenyl)oxamide.
What is the SMILES notation for N-(3-acetamidophenyl)-N'-(2,5-dichlorophenyl)oxamide?
The canonical SMILES for N-(3-acetamidophenyl)-N'-(2,5-dichlorophenyl)oxamide is CC(=O)Nc1cccc(NC(=O)C(=O)Nc2cc(Cl)ccc2Cl)c1.
What is the InChIKey of N-(3-acetamidophenyl)-N'-(2,5-dichlorophenyl)oxamide?
The InChIKey is FLUYLFLNUWPOQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13Cl2N3O3/c1-9(22)19-11-3-2-4-12(8-11)20-15(23)16(24)21-14-7-10(17)5-6-13(14)18/h2-8H,1H3,(H,19,22)(H,20,23)(H,21,24).
What are the key properties of N-(3-acetamidophenyl)-N'-(2,5-dichlorophenyl)oxamide?
N-(3-acetamidophenyl)-N'-(2,5-dichlorophenyl)oxamide has a molecular weight of 366.20 g/mol, XLogP of 3.53, 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'-(2,5-dichlorophenyl)oxamide is sourced from PubChem (CID 108501018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).