N'-(4-chloro-3-fluorophenyl)oxamide

C8H6ClFN2O2 — CID 70886699

IUPACN'-(4-chloro-3-fluorophenyl)oxamide
SMILESNC(=O)C(=O)Nc1ccc(Cl)c(F)c1
InChIInChI=1S/C8H6ClFN2O2/c9-5-2-1-4(3-6(5)10)12-8(14)7(11)13/h1-3H,(H2,11,13)(H,12,14)
InChIKeyVYAOVKIPVNMXAB-UHFFFAOYSA-N
MW216.60 g/mol
LogP0.90
Rot. Bonds1

About N'-(4-chloro-3-fluorophenyl)oxamide

N'-(4-chloro-3-fluorophenyl)oxamide (PubChem CID 70886699) has the molecular formula C8H6ClFN2O2 and a molecular weight of 216.60 g/mol. Its IUPAC name is N'-(4-chloro-3-fluorophenyl)oxamide.

Molecular Properties

Compound NameN'-(4-chloro-3-fluorophenyl)oxamide
PubChem CID70886699
Molecular FormulaC8H6ClFN2O2
Molecular Weight216.60 g/mol
Exact Mass216.01
IUPAC NameN'-(4-chloro-3-fluorophenyl)oxamide
SMILESNC(=O)C(=O)Nc1ccc(Cl)c(F)c1
InChIInChI=1S/C8H6ClFN2O2/c9-5-2-1-4(3-6(5)10)12-8(14)7(11)13/h1-3H,(H2,11,13)(H,12,14)
InChIKeyVYAOVKIPVNMXAB-UHFFFAOYSA-N
XLogP0.90
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.60
LogP ≤ 50.90
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

methyl 2-(4-chloro-3-fluoroanilino)-2-oxoacetate
CID 22934794
N-(4-chloro-3-fluorophenyl)acetamide
CID 60776248
N-(2-amino-2-sulfanylideneethyl)-N'-(4-chloro-3-fluorophenyl)oxamide
CID 54955496
N-(4-chloro-3-fluorophenyl)cyclopropanecarboxamide
CID 60776243
6-chloro-N-(4-chloro-3-fluorophenyl)pyridazine-3-carboxamide
CID 61042452
1-amino-N-(4-chloro-3-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride
CID 119708317
2-amino-N-(4-chloro-3-fluorophenyl)-3-methylbutanamide
CID 43708823
methyl 2-(4-chloro-3-fluoroanilino)prop-2-enoate
CID 70665556
N-(4-chloro-3-fluorophenyl)-3-sulfanylpropanamide
CID 107025056
N-(4-chloro-3-fluorophenyl)pyridine-4-carboxamide
CID 47228006
(2S)-2-amino-N-(4-chloro-3-fluorophenyl)-3,3-dimethylbutanamide
CID 61178407
1-amino-N-(4-chloro-3-fluorophenyl)cyclobutane-1-carboxamide
CID 81179055

Frequently Asked Questions

What is the IUPAC name of N'-(4-chloro-3-fluorophenyl)oxamide?
The IUPAC name of N'-(4-chloro-3-fluorophenyl)oxamide (CID 70886699) is N'-(4-chloro-3-fluorophenyl)oxamide.
What is the SMILES notation for N'-(4-chloro-3-fluorophenyl)oxamide?
The canonical SMILES for N'-(4-chloro-3-fluorophenyl)oxamide is NC(=O)C(=O)Nc1ccc(Cl)c(F)c1.
What is the InChIKey of N'-(4-chloro-3-fluorophenyl)oxamide?
The InChIKey is VYAOVKIPVNMXAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6ClFN2O2/c9-5-2-1-4(3-6(5)10)12-8(14)7(11)13/h1-3H,(H2,11,13)(H,12,14).
What are the key properties of N'-(4-chloro-3-fluorophenyl)oxamide?
N'-(4-chloro-3-fluorophenyl)oxamide has a molecular weight of 216.60 g/mol, XLogP of 0.90, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-chloro-3-fluorophenyl)oxamide is sourced from PubChem (CID 70886699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).