N-(4-fluorophenyl)-N'-(2-methylphenyl)oxamide

C15H13FN2O2 — CID 44998554

IUPACN-(4-fluorophenyl)-N'-(2-methylphenyl)oxamide
SMILESCc1ccccc1NC(=O)C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C15H13FN2O2/c1-10-4-2-3-5-13(10)18-15(20)14(19)17-12-8-6-11(16)7-9-12/h2-9H,1H3,(H,17,19)(H,18,20)
InChIKeyAOIOLYJFDFGXKW-UHFFFAOYSA-N
MW272.28 g/mol
LogP2.71
Rot. Bonds2

About N-(4-fluorophenyl)-N'-(2-methylphenyl)oxamide

N-(4-fluorophenyl)-N'-(2-methylphenyl)oxamide (PubChem CID 44998554) has the molecular formula C15H13FN2O2 and a molecular weight of 272.28 g/mol. Its IUPAC name is N-(4-fluorophenyl)-N'-(2-methylphenyl)oxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-N'-(2-methylphenyl)oxamide
PubChem CID44998554
Molecular FormulaC15H13FN2O2
Molecular Weight272.28 g/mol
Exact Mass272.10
IUPAC NameN-(4-fluorophenyl)-N'-(2-methylphenyl)oxamide
SMILESCc1ccccc1NC(=O)C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C15H13FN2O2/c1-10-4-2-3-5-13(10)18-15(20)14(19)17-12-8-6-11(16)7-9-12/h2-9H,1H3,(H,17,19)(H,18,20)
InChIKeyAOIOLYJFDFGXKW-UHFFFAOYSA-N
XLogP2.71
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.28
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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-(4-fluorophenyl)-N'-(2-methylphenyl)oxamide?
The IUPAC name of N-(4-fluorophenyl)-N'-(2-methylphenyl)oxamide (CID 44998554) is N-(4-fluorophenyl)-N'-(2-methylphenyl)oxamide.
What is the SMILES notation for N-(4-fluorophenyl)-N'-(2-methylphenyl)oxamide?
The canonical SMILES for N-(4-fluorophenyl)-N'-(2-methylphenyl)oxamide is Cc1ccccc1NC(=O)C(=O)Nc1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-N'-(2-methylphenyl)oxamide?
The InChIKey is AOIOLYJFDFGXKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN2O2/c1-10-4-2-3-5-13(10)18-15(20)14(19)17-12-8-6-11(16)7-9-12/h2-9H,1H3,(H,17,19)(H,18,20).
What are the key properties of N-(4-fluorophenyl)-N'-(2-methylphenyl)oxamide?
N-(4-fluorophenyl)-N'-(2-methylphenyl)oxamide has a molecular weight of 272.28 g/mol, XLogP of 2.71, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-N'-(2-methylphenyl)oxamide is sourced from PubChem (CID 44998554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).