2-(2-acetylanilino)-N-[4-(trifluoromethyl)cyclohexyl]acetamide

C17H21F3N2O2 — CID 75373937

IUPAC2-(2-acetylanilino)-N-[4-(trifluoromethyl)cyclohexyl]acetamide
SMILESCC(=O)c1ccccc1NCC(=O)NC1CCC(C(F)(F)F)CC1
InChIInChI=1S/C17H21F3N2O2/c1-11(23)14-4-2-3-5-15(14)21-10-16(24)22-13-8-6-12(7-9-13)17(18,19)20/h2-5,12-13,21H,6-10H2,1H3,(H,22,24)
InChIKeyKTPQBWJMNAXPSS-UHFFFAOYSA-N
MW342.36 g/mol
LogP3.54
Rot. Bonds5

About 2-(2-acetylanilino)-N-[4-(trifluoromethyl)cyclohexyl]acetamide

2-(2-acetylanilino)-N-[4-(trifluoromethyl)cyclohexyl]acetamide (PubChem CID 75373937) has the molecular formula C17H21F3N2O2 and a molecular weight of 342.36 g/mol. Its IUPAC name is 2-(2-acetylanilino)-N-[4-(trifluoromethyl)cyclohexyl]acetamide.

Molecular Properties

Compound Name2-(2-acetylanilino)-N-[4-(trifluoromethyl)cyclohexyl]acetamide
PubChem CID75373937
Molecular FormulaC17H21F3N2O2
Molecular Weight342.36 g/mol
Exact Mass342.16
IUPAC Name2-(2-acetylanilino)-N-[4-(trifluoromethyl)cyclohexyl]acetamide
SMILESCC(=O)c1ccccc1NCC(=O)NC1CCC(C(F)(F)F)CC1
InChIInChI=1S/C17H21F3N2O2/c1-11(23)14-4-2-3-5-15(14)21-10-16(24)22-13-8-6-12(7-9-13)17(18,19)20/h2-5,12-13,21H,6-10H2,1H3,(H,22,24)
InChIKeyKTPQBWJMNAXPSS-UHFFFAOYSA-N
XLogP3.54
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.36
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(cyclohexylamino)-2-oxoethyl]amino]-N,N-dimethylbenzamide
CID 86930985
N-cyclopropyl-2-(naphthalen-1-ylamino)acetamide
CID 26506369
N-cyclopropyl-2-[[2-oxo-2-(propylamino)ethyl]amino]benzamide
CID 32906957
N-cyclopropyl-2-[2-(methylsulfamoyl)anilino]acetamide
CID 43568446
N-[2-(cyclopropylamino)-2-oxoethyl]-2-(propylamino)benzamide
CID 62168218
2-(propan-2-ylamino)-N-[4-(trifluoromethyl)cyclohexyl]acetamide
CID 60718312
2-(2-acetylanilino)-N-phenylacetamide
CID 9103782
2-(2-acetylanilino)-N-(tert-butylcarbamoyl)acetamide
CID 26526540
2-amino-N-[4-(trifluoromethyl)cyclohexyl]benzamide
CID 61213533
2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide
CID 18144272
2-[[2-(cyclohexylamino)-2-oxoethyl]amino]-N-(2-methylpropyl)benzamide
CID 86911442
N-cycloheptyl-2-(2-ethylanilino)acetamide
CID 60631370

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetylanilino)-N-[4-(trifluoromethyl)cyclohexyl]acetamide?
The IUPAC name of 2-(2-acetylanilino)-N-[4-(trifluoromethyl)cyclohexyl]acetamide (CID 75373937) is 2-(2-acetylanilino)-N-[4-(trifluoromethyl)cyclohexyl]acetamide.
What is the SMILES notation for 2-(2-acetylanilino)-N-[4-(trifluoromethyl)cyclohexyl]acetamide?
The canonical SMILES for 2-(2-acetylanilino)-N-[4-(trifluoromethyl)cyclohexyl]acetamide is CC(=O)c1ccccc1NCC(=O)NC1CCC(C(F)(F)F)CC1.
What is the InChIKey of 2-(2-acetylanilino)-N-[4-(trifluoromethyl)cyclohexyl]acetamide?
The InChIKey is KTPQBWJMNAXPSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21F3N2O2/c1-11(23)14-4-2-3-5-15(14)21-10-16(24)22-13-8-6-12(7-9-13)17(18,19)20/h2-5,12-13,21H,6-10H2,1H3,(H,22,24).
What are the key properties of 2-(2-acetylanilino)-N-[4-(trifluoromethyl)cyclohexyl]acetamide?
2-(2-acetylanilino)-N-[4-(trifluoromethyl)cyclohexyl]acetamide has a molecular weight of 342.36 g/mol, XLogP of 3.54, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetylanilino)-N-[4-(trifluoromethyl)cyclohexyl]acetamide is sourced from PubChem (CID 75373937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).