2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylacetamide

C15H10Cl2F3NO — CID 4117637

IUPAC2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylacetamide
SMILESO=C(Nc1cc(C(F)(F)F)ccc1Cl)C(Cl)c1ccccc1
InChIInChI=1S/C15H10Cl2F3NO/c16-11-7-6-10(15(18,19)20)8-12(11)21-14(22)13(17)9-4-2-1-3-5-9/h1-8,13H,(H,21,22)
InChIKeyRZBPCVWWCYSNQO-UHFFFAOYSA-N
MW348.15 g/mol
LogP5.28
Rot. Bonds3

About 2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylacetamide

2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylacetamide (PubChem CID 4117637) has the molecular formula C15H10Cl2F3NO and a molecular weight of 348.15 g/mol. Its IUPAC name is 2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylacetamide.

Molecular Properties

Compound Name2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylacetamide
PubChem CID4117637
Molecular FormulaC15H10Cl2F3NO
Molecular Weight348.15 g/mol
Exact Mass347.01
IUPAC Name2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylacetamide
SMILESO=C(Nc1cc(C(F)(F)F)ccc1Cl)C(Cl)c1ccccc1
InChIInChI=1S/C15H10Cl2F3NO/c16-11-7-6-10(15(18,19)20)8-12(11)21-14(22)13(17)9-4-2-1-3-5-9/h1-8,13H,(H,21,22)
InChIKeyRZBPCVWWCYSNQO-UHFFFAOYSA-N
XLogP5.28
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.15
LogP ≤ 55.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-[2-chloro-5-(trifluoromethyl)phenyl]-3-(1-phenylethyl)urea
CID 17087713
(2R)-2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]propanamide
CID 2396545
[(1R)-2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2,6-difluorobenzoate
CID 2367295
1-[2-chloro-5-(trifluoromethyl)phenyl]-3-(3,3-diphenylpropyl)urea
CID 17087721
2-chloro-2-phenyl-N-[4-(trifluoromethyl)phenyl]acetamide
CID 43082478
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenoxypropanamide
CID 3259116
(2R)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylsulfanylpropanamide
CID 7820937
[(1R)-2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl]-prop-2-ynylazanium
CID 9357594
[(1S)-2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 4-tert-butylbenzoate
CID 2392218
(2R)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-2-phenylacetamide
CID 41082155
[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-phenylsulfanylacetate
CID 4005451
[(1S)-2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-benzoylbenzoate
CID 2431209

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylacetamide?
The IUPAC name of 2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylacetamide (CID 4117637) is 2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylacetamide.
What is the SMILES notation for 2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylacetamide?
The canonical SMILES for 2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylacetamide is O=C(Nc1cc(C(F)(F)F)ccc1Cl)C(Cl)c1ccccc1.
What is the InChIKey of 2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylacetamide?
The InChIKey is RZBPCVWWCYSNQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl2F3NO/c16-11-7-6-10(15(18,19)20)8-12(11)21-14(22)13(17)9-4-2-1-3-5-9/h1-8,13H,(H,21,22).
What are the key properties of 2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylacetamide?
2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylacetamide has a molecular weight of 348.15 g/mol, XLogP of 5.28, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylacetamide is sourced from PubChem (CID 4117637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).