N'-(3-chloro-4-fluorophenyl)-N-(2-hydroxyethyl)oxamide

C10H10ClFN2O3 — CID 7585032

IUPACN'-(3-chloro-4-fluorophenyl)-N-(2-hydroxyethyl)oxamide
SMILESO=C(NCCO)C(=O)Nc1ccc(F)c(Cl)c1
InChIInChI=1S/C10H10ClFN2O3/c11-7-5-6(1-2-8(7)12)14-10(17)9(16)13-3-4-15/h1-2,5,15H,3-4H2,(H,13,16)(H,14,17)
InChIKeyGQONNGACBBWLAZ-UHFFFAOYSA-N
MW260.65 g/mol
LogP0.53
Rot. Bonds3

About N'-(3-chloro-4-fluorophenyl)-N-(2-hydroxyethyl)oxamide

N'-(3-chloro-4-fluorophenyl)-N-(2-hydroxyethyl)oxamide (PubChem CID 7585032) has the molecular formula C10H10ClFN2O3 and a molecular weight of 260.65 g/mol. Its IUPAC name is N'-(3-chloro-4-fluorophenyl)-N-(2-hydroxyethyl)oxamide.

Molecular Properties

Compound NameN'-(3-chloro-4-fluorophenyl)-N-(2-hydroxyethyl)oxamide
PubChem CID7585032
Molecular FormulaC10H10ClFN2O3
Molecular Weight260.65 g/mol
Exact Mass260.04
IUPAC NameN'-(3-chloro-4-fluorophenyl)-N-(2-hydroxyethyl)oxamide
SMILESO=C(NCCO)C(=O)Nc1ccc(F)c(Cl)c1
InChIInChI=1S/C10H10ClFN2O3/c11-7-5-6(1-2-8(7)12)14-10(17)9(16)13-3-4-15/h1-2,5,15H,3-4H2,(H,13,16)(H,14,17)
InChIKeyGQONNGACBBWLAZ-UHFFFAOYSA-N
XLogP0.53
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.65
LogP ≤ 50.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(3-chloro-4-fluorophenyl)-3-(2-hydroxyethyl)urea
CID 47238015
N'-(3-chloro-4-fluorophenyl)-N-(3-hydroxy-4,4-dimethylpentyl)oxamide
CID 90523603
N'-(3-chloro-4-fluorophenyl)-N-(4-methylphenyl)oxamide
CID 44998410
N'-(3-chloro-4-fluorophenyl)-N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)oxamide
CID 90523212
N'-(2,4-dichlorophenyl)-N-(2-hydroxyethyl)oxamide
CID 78843041
N'-(3-chloro-4-fluorophenyl)-N-[3-[4-(4-chlorophenyl)piperazin-1-yl]propyl]oxamide
CID 42389821
N'-(3-chloro-4-fluorophenyl)-N-[2-(3-methoxyphenyl)ethyl]oxamide
CID 44998421
N'-(3-chloro-4-fluorophenyl)-N-[4-(trifluoromethyl)phenyl]oxamide
CID 108530569
N'-(4-fluoro-3-methylphenyl)-N-(3-hydroxypropyl)oxamide
CID 110933503
N'-(3-chloro-4-fluorophenyl)-N-[(2S)-2-hydroxy-2-phenylpropyl]oxamide
CID 95368093
N'-(3-chloro-4-fluorophenyl)-N-[(6-hydroxy-1,4-dithiepan-6-yl)methyl]oxamide
CID 146080792
N'-(3-chloro-4-fluorophenyl)-N-(4-methoxyphenyl)oxamide
CID 44998409

Frequently Asked Questions

What is the IUPAC name of N'-(3-chloro-4-fluorophenyl)-N-(2-hydroxyethyl)oxamide?
The IUPAC name of N'-(3-chloro-4-fluorophenyl)-N-(2-hydroxyethyl)oxamide (CID 7585032) is N'-(3-chloro-4-fluorophenyl)-N-(2-hydroxyethyl)oxamide.
What is the SMILES notation for N'-(3-chloro-4-fluorophenyl)-N-(2-hydroxyethyl)oxamide?
The canonical SMILES for N'-(3-chloro-4-fluorophenyl)-N-(2-hydroxyethyl)oxamide is O=C(NCCO)C(=O)Nc1ccc(F)c(Cl)c1.
What is the InChIKey of N'-(3-chloro-4-fluorophenyl)-N-(2-hydroxyethyl)oxamide?
The InChIKey is GQONNGACBBWLAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClFN2O3/c11-7-5-6(1-2-8(7)12)14-10(17)9(16)13-3-4-15/h1-2,5,15H,3-4H2,(H,13,16)(H,14,17).
What are the key properties of N'-(3-chloro-4-fluorophenyl)-N-(2-hydroxyethyl)oxamide?
N'-(3-chloro-4-fluorophenyl)-N-(2-hydroxyethyl)oxamide has a molecular weight of 260.65 g/mol, XLogP of 0.53, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-chloro-4-fluorophenyl)-N-(2-hydroxyethyl)oxamide is sourced from PubChem (CID 7585032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).