N'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide

C15H13ClN2O3 — CID 45000733

IUPACN'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide
SMILESCOc1cccc(NC(=O)C(=O)Nc2ccccc2Cl)c1
InChIInChI=1S/C15H13ClN2O3/c1-21-11-6-4-5-10(9-11)17-14(19)15(20)18-13-8-3-2-7-12(13)16/h2-9H,1H3,(H,17,19)(H,18,20)
InChIKeyZGVJQRVMDVFBKR-UHFFFAOYSA-N
MW304.73 g/mol
LogP2.93
Rot. Bonds3

About N'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide

N'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide (PubChem CID 45000733) has the molecular formula C15H13ClN2O3 and a molecular weight of 304.73 g/mol. Its IUPAC name is N'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide.

Molecular Properties

Compound NameN'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide
PubChem CID45000733
Molecular FormulaC15H13ClN2O3
Molecular Weight304.73 g/mol
Exact Mass304.06
IUPAC NameN'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide
SMILESCOc1cccc(NC(=O)C(=O)Nc2ccccc2Cl)c1
InChIInChI=1S/C15H13ClN2O3/c1-21-11-6-4-5-10(9-11)17-14(19)15(20)18-13-8-3-2-7-12(13)16/h2-9H,1H3,(H,17,19)(H,18,20)
InChIKeyZGVJQRVMDVFBKR-UHFFFAOYSA-N
XLogP2.93
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.73
LogP ≤ 52.93
H-Bond Donors ≤ 52
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'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide?
The IUPAC name of N'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide (CID 45000733) is N'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide.
What is the SMILES notation for N'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide?
The canonical SMILES for N'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide is COc1cccc(NC(=O)C(=O)Nc2ccccc2Cl)c1.
What is the InChIKey of N'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide?
The InChIKey is ZGVJQRVMDVFBKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2O3/c1-21-11-6-4-5-10(9-11)17-14(19)15(20)18-13-8-3-2-7-12(13)16/h2-9H,1H3,(H,17,19)(H,18,20).
What are the key properties of N'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide?
N'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide has a molecular weight of 304.73 g/mol, XLogP of 2.93, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide is sourced from PubChem (CID 45000733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).