2-(N-acetyl-3-chloroanilino)-N-[2-(trifluoromethyl)phenyl]acetamide

C17H14ClF3N2O2 — CID 113171420

IUPAC2-(N-acetyl-3-chloroanilino)-N-[2-(trifluoromethyl)phenyl]acetamide
SMILESCC(=O)N(CC(=O)Nc1ccccc1C(F)(F)F)c1cccc(Cl)c1
InChIInChI=1S/C17H14ClF3N2O2/c1-11(24)23(13-6-4-5-12(18)9-13)10-16(25)22-15-8-3-2-7-14(15)17(19,20)21/h2-9H,10H2,1H3,(H,22,25)
InChIKeyKMYAYAWUACRECZ-UHFFFAOYSA-N
MW370.76 g/mol
LogP4.35
Rot. Bonds4

About 2-(N-acetyl-3-chloroanilino)-N-[2-(trifluoromethyl)phenyl]acetamide

2-(N-acetyl-3-chloroanilino)-N-[2-(trifluoromethyl)phenyl]acetamide (PubChem CID 113171420) has the molecular formula C17H14ClF3N2O2 and a molecular weight of 370.76 g/mol. Its IUPAC name is 2-(N-acetyl-3-chloroanilino)-N-[2-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(N-acetyl-3-chloroanilino)-N-[2-(trifluoromethyl)phenyl]acetamide
PubChem CID113171420
Molecular FormulaC17H14ClF3N2O2
Molecular Weight370.76 g/mol
Exact Mass370.07
IUPAC Name2-(N-acetyl-3-chloroanilino)-N-[2-(trifluoromethyl)phenyl]acetamide
SMILESCC(=O)N(CC(=O)Nc1ccccc1C(F)(F)F)c1cccc(Cl)c1
InChIInChI=1S/C17H14ClF3N2O2/c1-11(24)23(13-6-4-5-12(18)9-13)10-16(25)22-15-8-3-2-7-14(15)17(19,20)21/h2-9H,10H2,1H3,(H,22,25)
InChIKeyKMYAYAWUACRECZ-UHFFFAOYSA-N
XLogP4.35
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.76
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N-acetyl-3-chloroanilino)-N-(2-propan-2-yloxyphenyl)acetamide
CID 113171415
2-(N-acetyl-3-chloroanilino)-N-(2-phenoxyphenyl)acetamide
CID 113171452
2-[N-acetyl-3-(trifluoromethyl)anilino]-N-(5-chloro-2-methylphenyl)acetamide
CID 113175197
3-(N-acetyl-4-chloro-2-methylanilino)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 113127924
2-[N-acetyl-2-(trifluoromethyl)anilino]-N-(4-chloro-2-methylphenyl)acetamide
CID 113175063
2-(N-acetyl-3,5-dichloroanilino)-N-(2-fluorophenyl)acetamide
CID 113179895
2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-(2-cyanophenyl)acetamide
CID 113179388
2-(N-acetyl-3-chloroanilino)-N-(3-methylphenyl)acetamide
CID 113171372
2-(N-acetyl-3-chloroanilino)-N-(2,4,6-trimethylphenyl)acetamide
CID 113171389
2-(N-acetyl-3-fluoroanilino)-N-(2,5-dichlorophenyl)acetamide
CID 113177743
2-(N-acetyl-3-chloroanilino)-N-(2-methylpropyl)acetamide
CID 113171290
2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 21383101

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-3-chloroanilino)-N-[2-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-(N-acetyl-3-chloroanilino)-N-[2-(trifluoromethyl)phenyl]acetamide (CID 113171420) is 2-(N-acetyl-3-chloroanilino)-N-[2-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-(N-acetyl-3-chloroanilino)-N-[2-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-(N-acetyl-3-chloroanilino)-N-[2-(trifluoromethyl)phenyl]acetamide is CC(=O)N(CC(=O)Nc1ccccc1C(F)(F)F)c1cccc(Cl)c1.
What is the InChIKey of 2-(N-acetyl-3-chloroanilino)-N-[2-(trifluoromethyl)phenyl]acetamide?
The InChIKey is KMYAYAWUACRECZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClF3N2O2/c1-11(24)23(13-6-4-5-12(18)9-13)10-16(25)22-15-8-3-2-7-14(15)17(19,20)21/h2-9H,10H2,1H3,(H,22,25).
What are the key properties of 2-(N-acetyl-3-chloroanilino)-N-[2-(trifluoromethyl)phenyl]acetamide?
2-(N-acetyl-3-chloroanilino)-N-[2-(trifluoromethyl)phenyl]acetamide has a molecular weight of 370.76 g/mol, XLogP of 4.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-3-chloroanilino)-N-[2-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 113171420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).