N'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide

C14H11ClFN3O2 — CID 108516241

IUPACN'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide
SMILESNc1ccc(NC(=O)C(=O)Nc2cccc(F)c2)cc1Cl
InChIInChI=1S/C14H11ClFN3O2/c15-11-7-10(4-5-12(11)17)19-14(21)13(20)18-9-3-1-2-8(16)6-9/h1-7H,17H2,(H,18,20)(H,19,21)
InChIKeyJFZSHMOZMQUZFI-UHFFFAOYSA-N
MW307.71 g/mol
LogP2.64
Rot. Bonds2

About N'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide

N'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide (PubChem CID 108516241) has the molecular formula C14H11ClFN3O2 and a molecular weight of 307.71 g/mol. Its IUPAC name is N'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide.

Molecular Properties

Compound NameN'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide
PubChem CID108516241
Molecular FormulaC14H11ClFN3O2
Molecular Weight307.71 g/mol
Exact Mass307.05
IUPAC NameN'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide
SMILESNc1ccc(NC(=O)C(=O)Nc2cccc(F)c2)cc1Cl
InChIInChI=1S/C14H11ClFN3O2/c15-11-7-10(4-5-12(11)17)19-14(21)13(20)18-9-3-1-2-8(16)6-9/h1-7H,17H2,(H,18,20)(H,19,21)
InChIKeyJFZSHMOZMQUZFI-UHFFFAOYSA-N
XLogP2.64
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.71
LogP ≤ 52.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide
CID 108516155
N'-(3-acetylphenyl)-N-(4-amino-3-chlorophenyl)oxamide
CID 108514915
N'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide
CID 108515975
N'-(4-amino-3-chlorophenyl)-N-[(4-fluorophenyl)methyl]oxamide
CID 108516187
1-(4-amino-3-chlorophenyl)-3-[(E)-2-(3-fluorophenyl)ethenyl]urea
CID 108906166
1-(3-chloro-4-fluorophenyl)-3-(3-fluorophenyl)urea
CID 108893983
N-(4-amino-3-chlorophenyl)-N'-(3,5-dimethylphenyl)oxamide
CID 108516205
N-(4-amino-3-chlorophenyl)-N'-benzhydryloxamide
CID 108507997
(4-amino-3-chlorophenyl)carbamic acid
CID 18543733
N-(4-amino-3-chlorophenyl)-N'-(2,4-dichlorophenyl)oxamide
CID 108502772
N'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide
CID 108522116
N'-(3-bromophenyl)-N-(3-fluorophenyl)oxamide
CID 108529598

Frequently Asked Questions

What is the IUPAC name of N'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide?
The IUPAC name of N'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide (CID 108516241) is N'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide.
What is the SMILES notation for N'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide?
The canonical SMILES for N'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide is Nc1ccc(NC(=O)C(=O)Nc2cccc(F)c2)cc1Cl.
What is the InChIKey of N'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide?
The InChIKey is JFZSHMOZMQUZFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClFN3O2/c15-11-7-10(4-5-12(11)17)19-14(21)13(20)18-9-3-1-2-8(16)6-9/h1-7H,17H2,(H,18,20)(H,19,21).
What are the key properties of N'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide?
N'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide has a molecular weight of 307.71 g/mol, XLogP of 2.64, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide is sourced from PubChem (CID 108516241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).