N-(3-acetylphenyl)-2-[2-chloro-5-(trifluoromethyl)anilino]acetamide

C17H14ClF3N2O2 — CID 109009852

IUPACN-(3-acetylphenyl)-2-[2-chloro-5-(trifluoromethyl)anilino]acetamide
SMILESCC(=O)c1cccc(NC(=O)CNc2cc(C(F)(F)F)ccc2Cl)c1
InChIInChI=1S/C17H14ClF3N2O2/c1-10(24)11-3-2-4-13(7-11)23-16(25)9-22-15-8-12(17(19,20)21)5-6-14(15)18/h2-8,22H,9H2,1H3,(H,23,25)
InChIKeySRINFPHCYNCEOP-UHFFFAOYSA-N
MW370.76 g/mol
LogP4.61
Rot. Bonds5

About N-(3-acetylphenyl)-2-[2-chloro-5-(trifluoromethyl)anilino]acetamide

N-(3-acetylphenyl)-2-[2-chloro-5-(trifluoromethyl)anilino]acetamide (PubChem CID 109009852) has the molecular formula C17H14ClF3N2O2 and a molecular weight of 370.76 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-[2-chloro-5-(trifluoromethyl)anilino]acetamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-[2-chloro-5-(trifluoromethyl)anilino]acetamide
PubChem CID109009852
Molecular FormulaC17H14ClF3N2O2
Molecular Weight370.76 g/mol
Exact Mass370.07
IUPAC NameN-(3-acetylphenyl)-2-[2-chloro-5-(trifluoromethyl)anilino]acetamide
SMILESCC(=O)c1cccc(NC(=O)CNc2cc(C(F)(F)F)ccc2Cl)c1
InChIInChI=1S/C17H14ClF3N2O2/c1-10(24)11-3-2-4-13(7-11)23-16(25)9-22-15-8-12(17(19,20)21)5-6-14(15)18/h2-8,22H,9H2,1H3,(H,23,25)
InChIKeySRINFPHCYNCEOP-UHFFFAOYSA-N
XLogP4.61
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.76
LogP ≤ 54.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-acetylphenyl)-2-[2-chloro-5-(hydroxymethyl)anilino]acetamide
CID 110923541
N-(3-acetylphenyl)-2-(2,3-dichloroanilino)acetamide
CID 42069766
2-[2-chloro-5-(trifluoromethyl)anilino]-N-(2,5-dimethylphenyl)acetamide
CID 109007403
N-tert-butyl-3-[[2-(2,5-dichloroanilino)acetyl]amino]benzamide
CID 54819787
3-[2-chloro-5-(trifluoromethyl)anilino]-N-(3-fluorophenyl)propanamide
CID 109041600
N-(3,4-dichlorophenyl)-2-[3-(trifluoromethyl)anilino]acetamide
CID 7922707
N-(3-acetylphenyl)-2-(4-chloroanilino)acetamide
CID 26506544
2-(3-acetylanilino)-N-(3-chloro-4-fluorophenyl)acetamide
CID 9084520
3-[[2-[3-(trifluoromethyl)anilino]acetyl]amino]benzamide
CID 54833567
3-[[2-(2,3-dimethylanilino)acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 54815970
N-[2-chloro-5-(trifluoromethyl)phenyl]-3-(2-methylpropanoylamino)benzamide
CID 1302692
N-tert-butyl-3-[[2-[3-(trifluoromethyl)anilino]acetyl]amino]benzamide
CID 54833776

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-[2-chloro-5-(trifluoromethyl)anilino]acetamide?
The IUPAC name of N-(3-acetylphenyl)-2-[2-chloro-5-(trifluoromethyl)anilino]acetamide (CID 109009852) is N-(3-acetylphenyl)-2-[2-chloro-5-(trifluoromethyl)anilino]acetamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-[2-chloro-5-(trifluoromethyl)anilino]acetamide?
The canonical SMILES for N-(3-acetylphenyl)-2-[2-chloro-5-(trifluoromethyl)anilino]acetamide is CC(=O)c1cccc(NC(=O)CNc2cc(C(F)(F)F)ccc2Cl)c1.
What is the InChIKey of N-(3-acetylphenyl)-2-[2-chloro-5-(trifluoromethyl)anilino]acetamide?
The InChIKey is SRINFPHCYNCEOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClF3N2O2/c1-10(24)11-3-2-4-13(7-11)23-16(25)9-22-15-8-12(17(19,20)21)5-6-14(15)18/h2-8,22H,9H2,1H3,(H,23,25).
What are the key properties of N-(3-acetylphenyl)-2-[2-chloro-5-(trifluoromethyl)anilino]acetamide?
N-(3-acetylphenyl)-2-[2-chloro-5-(trifluoromethyl)anilino]acetamide has a molecular weight of 370.76 g/mol, XLogP of 4.61, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-[2-chloro-5-(trifluoromethyl)anilino]acetamide is sourced from PubChem (CID 109009852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).