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

C18H16ClF3N2O2 — CID 113175197

IUPAC2-[N-acetyl-3-(trifluoromethyl)anilino]-N-(5-chloro-2-methylphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1cc(Cl)ccc1C)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C18H16ClF3N2O2/c1-11-6-7-14(19)9-16(11)23-17(26)10-24(12(2)25)15-5-3-4-13(8-15)18(20,21)22/h3-9H,10H2,1-2H3,(H,23,26)
InChIKeyOROMVWGBDWQAHA-UHFFFAOYSA-N
MW384.79 g/mol
LogP4.66
Rot. Bonds4

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

2-[N-acetyl-3-(trifluoromethyl)anilino]-N-(5-chloro-2-methylphenyl)acetamide (PubChem CID 113175197) has the molecular formula C18H16ClF3N2O2 and a molecular weight of 384.79 g/mol. Its IUPAC name is 2-[N-acetyl-3-(trifluoromethyl)anilino]-N-(5-chloro-2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[N-acetyl-3-(trifluoromethyl)anilino]-N-(5-chloro-2-methylphenyl)acetamide
PubChem CID113175197
Molecular FormulaC18H16ClF3N2O2
Molecular Weight384.79 g/mol
Exact Mass384.09
IUPAC Name2-[N-acetyl-3-(trifluoromethyl)anilino]-N-(5-chloro-2-methylphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1cc(Cl)ccc1C)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C18H16ClF3N2O2/c1-11-6-7-14(19)9-16(11)23-17(26)10-24(12(2)25)15-5-3-4-13(8-15)18(20,21)22/h3-9H,10H2,1-2H3,(H,23,26)
InChIKeyOROMVWGBDWQAHA-UHFFFAOYSA-N
XLogP4.66
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.79
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N-acetyl-4-chloroanilino)-N-(5-chloro-2-methylphenyl)acetamide
CID 113171587
2-[N-acetyl-3-(trifluoromethyl)anilino]-N-(2,6-difluorophenyl)acetamide
CID 113175232
2-(N-acetyl-3,4-dimethylanilino)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 113168375
2-(N-acetyl-3-chloroanilino)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 113171420
2-(N-acetyl-2-fluoroanilino)-N-(5-chloro-2-methylphenyl)acetamide
CID 113170823
2-(N-acetyl-3-fluoroanilino)-N-(2,5-dichlorophenyl)acetamide
CID 113177743
N-(4-acetylphenyl)-2-[N-acetyl-3-(trifluoromethyl)anilino]acetamide
CID 113175214
N-(5-chloro-2-methylphenyl)-2-[ethyl-[3-(trifluoromethyl)phenyl]sulfonylamino]acetamide
CID 2119470
methyl 4-[acetyl-[2-(5-chloro-2-methylanilino)-2-oxoethyl]amino]benzoate
CID 113176448
2-(N-acetyl-3-bromoanilino)-N-(4-chloro-2-methylphenyl)acetamide
CID 113177955
2-(N-acetyl-3-chloro-4-methylanilino)-N-(4-chloro-2-methylphenyl)acetamide
CID 113172270
2-[N-acetyl-3-(trifluoromethyl)anilino]-N-prop-2-enylacetamide
CID 113175103

Frequently Asked Questions

What is the IUPAC name of 2-[N-acetyl-3-(trifluoromethyl)anilino]-N-(5-chloro-2-methylphenyl)acetamide?
The IUPAC name of 2-[N-acetyl-3-(trifluoromethyl)anilino]-N-(5-chloro-2-methylphenyl)acetamide (CID 113175197) is 2-[N-acetyl-3-(trifluoromethyl)anilino]-N-(5-chloro-2-methylphenyl)acetamide.
What is the SMILES notation for 2-[N-acetyl-3-(trifluoromethyl)anilino]-N-(5-chloro-2-methylphenyl)acetamide?
The canonical SMILES for 2-[N-acetyl-3-(trifluoromethyl)anilino]-N-(5-chloro-2-methylphenyl)acetamide is CC(=O)N(CC(=O)Nc1cc(Cl)ccc1C)c1cccc(C(F)(F)F)c1.
What is the InChIKey of 2-[N-acetyl-3-(trifluoromethyl)anilino]-N-(5-chloro-2-methylphenyl)acetamide?
The InChIKey is OROMVWGBDWQAHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16ClF3N2O2/c1-11-6-7-14(19)9-16(11)23-17(26)10-24(12(2)25)15-5-3-4-13(8-15)18(20,21)22/h3-9H,10H2,1-2H3,(H,23,26).
What are the key properties of 2-[N-acetyl-3-(trifluoromethyl)anilino]-N-(5-chloro-2-methylphenyl)acetamide?
2-[N-acetyl-3-(trifluoromethyl)anilino]-N-(5-chloro-2-methylphenyl)acetamide has a molecular weight of 384.79 g/mol, XLogP of 4.66, 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-(trifluoromethyl)anilino]-N-(5-chloro-2-methylphenyl)acetamide is sourced from PubChem (CID 113175197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).