N'-(5-chloro-2-methylphenyl)-N-(3-fluorophenyl)oxamide

C15H12ClFN2O2 — CID 108511843

IUPACN'-(5-chloro-2-methylphenyl)-N-(3-fluorophenyl)oxamide
SMILESCc1ccc(Cl)cc1NC(=O)C(=O)Nc1cccc(F)c1
InChIInChI=1S/C15H12ClFN2O2/c1-9-5-6-10(16)7-13(9)19-15(21)14(20)18-12-4-2-3-11(17)8-12/h2-8H,1H3,(H,18,20)(H,19,21)
InChIKeyTVHCOIYPTUJNTM-UHFFFAOYSA-N
MW306.72 g/mol
LogP3.36
Rot. Bonds2

About N'-(5-chloro-2-methylphenyl)-N-(3-fluorophenyl)oxamide

N'-(5-chloro-2-methylphenyl)-N-(3-fluorophenyl)oxamide (PubChem CID 108511843) has the molecular formula C15H12ClFN2O2 and a molecular weight of 306.72 g/mol. Its IUPAC name is N'-(5-chloro-2-methylphenyl)-N-(3-fluorophenyl)oxamide.

Molecular Properties

Compound NameN'-(5-chloro-2-methylphenyl)-N-(3-fluorophenyl)oxamide
PubChem CID108511843
Molecular FormulaC15H12ClFN2O2
Molecular Weight306.72 g/mol
Exact Mass306.06
IUPAC NameN'-(5-chloro-2-methylphenyl)-N-(3-fluorophenyl)oxamide
SMILESCc1ccc(Cl)cc1NC(=O)C(=O)Nc1cccc(F)c1
InChIInChI=1S/C15H12ClFN2O2/c1-9-5-6-10(16)7-13(9)19-15(21)14(20)18-12-4-2-3-11(17)8-12/h2-8H,1H3,(H,18,20)(H,19,21)
InChIKeyTVHCOIYPTUJNTM-UHFFFAOYSA-N
XLogP3.36
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.72
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-(5-chloro-2-methylphenyl)-N-(2,5-difluorophenyl)oxamide
CID 108511873
1-N'-(5-chloro-2-methylphenyl)-1-N-(3-fluorophenyl)cyclopropane-1,1-dicarboxamide
CID 108982710
2-[[2-(5-chloro-2-methylanilino)-2-oxoethyl]-ethylamino]-N-(3-fluorophenyl)acetamide
CID 8780475
N'-(2,6-dimethylphenyl)-N-(3-fluorophenyl)oxamide
CID 108531930
2-(4-chloro-2-methylanilino)-N-(3-fluorophenyl)acetamide
CID 26507132
2-(4-chlorophenyl)-N-(3-fluorophenyl)-2-oxoacetamide
CID 94286978
N-[2-(4-chlorophenyl)ethyl]-N'-(3-fluorophenyl)oxamide
CID 7292818
N-(3-acetamidophenyl)-N'-(2,5-dichlorophenyl)oxamide
CID 108501018
N-(3-chlorophenyl)-N'-(2,3,4-trifluorophenyl)oxamide
CID 108516579
2-chloro-N-(5-chloro-2-methylphenyl)prop-2-enamide
CID 131001051
N'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide
CID 108522116
N-[(4-chlorophenyl)methyl]-N'-(3-fluorophenyl)oxamide
CID 2272581

Frequently Asked Questions

What is the IUPAC name of N'-(5-chloro-2-methylphenyl)-N-(3-fluorophenyl)oxamide?
The IUPAC name of N'-(5-chloro-2-methylphenyl)-N-(3-fluorophenyl)oxamide (CID 108511843) is N'-(5-chloro-2-methylphenyl)-N-(3-fluorophenyl)oxamide.
What is the SMILES notation for N'-(5-chloro-2-methylphenyl)-N-(3-fluorophenyl)oxamide?
The canonical SMILES for N'-(5-chloro-2-methylphenyl)-N-(3-fluorophenyl)oxamide is Cc1ccc(Cl)cc1NC(=O)C(=O)Nc1cccc(F)c1.
What is the InChIKey of N'-(5-chloro-2-methylphenyl)-N-(3-fluorophenyl)oxamide?
The InChIKey is TVHCOIYPTUJNTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClFN2O2/c1-9-5-6-10(16)7-13(9)19-15(21)14(20)18-12-4-2-3-11(17)8-12/h2-8H,1H3,(H,18,20)(H,19,21).
What are the key properties of N'-(5-chloro-2-methylphenyl)-N-(3-fluorophenyl)oxamide?
N'-(5-chloro-2-methylphenyl)-N-(3-fluorophenyl)oxamide has a molecular weight of 306.72 g/mol, XLogP of 3.36, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(5-chloro-2-methylphenyl)-N-(3-fluorophenyl)oxamide is sourced from PubChem (CID 108511843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).