2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylacetamide

C17H20ClF3N2O2 — CID 113179338

IUPAC2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylacetamide
SMILESCC(=O)N(CC(=O)NC1CCCCC1)c1ccc(Cl)cc1C(F)(F)F
InChIInChI=1S/C17H20ClF3N2O2/c1-11(24)23(10-16(25)22-13-5-3-2-4-6-13)15-8-7-12(18)9-14(15)17(19,20)21/h7-9,13H,2-6,10H2,1H3,(H,22,25)
InChIKeyJHPVPDOIMLLKFT-UHFFFAOYSA-N
MW376.81 g/mol
LogP4.16
Rot. Bonds4

About 2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylacetamide

2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylacetamide (PubChem CID 113179338) has the molecular formula C17H20ClF3N2O2 and a molecular weight of 376.81 g/mol. Its IUPAC name is 2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylacetamide.

Molecular Properties

Compound Name2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylacetamide
PubChem CID113179338
Molecular FormulaC17H20ClF3N2O2
Molecular Weight376.81 g/mol
Exact Mass376.12
IUPAC Name2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylacetamide
SMILESCC(=O)N(CC(=O)NC1CCCCC1)c1ccc(Cl)cc1C(F)(F)F
InChIInChI=1S/C17H20ClF3N2O2/c1-11(24)23(10-16(25)22-13-5-3-2-4-6-13)15-8-7-12(18)9-14(15)17(19,20)21/h7-9,13H,2-6,10H2,1H3,(H,22,25)
InChIKeyJHPVPDOIMLLKFT-UHFFFAOYSA-N
XLogP4.16
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.81
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-cycloheptylacetamide
CID 113179362
N-[4-chloro-2-(trifluoromethyl)phenyl]-N-(2-oxo-2-piperidin-1-ylethyl)acetamide
CID 113179337
2-(N-acetyl-2-tert-butylanilino)-N-cycloheptylacetamide
CID 113170454
2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-(2-methoxyethyl)acetamide
CID 113179340
2-(N-acetyl-2-tert-butylanilino)-N-cyclopentylacetamide
CID 113170397
3-[N-acetyl-2-(trifluoromethyl)anilino]-N-cycloheptylpropanamide
CID 113130347
2-(N-acetyl-2,6-difluoroanilino)-N-cycloheptylacetamide
CID 113181443
2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-(2-cyanophenyl)acetamide
CID 113179388
2-(N-acetyl-3-chloro-4-methylanilino)-N-cycloheptylacetamide
CID 113172228
3-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-(oxolan-2-ylmethyl)propanamide
CID 113133699
2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-(pyridin-3-ylmethyl)acetamide
CID 113179357
2-(N-acetyl-2,3-dimethylanilino)-N-cycloheptylacetamide
CID 113168893

Frequently Asked Questions

What is the IUPAC name of 2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylacetamide?
The IUPAC name of 2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylacetamide (CID 113179338) is 2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylacetamide.
What is the SMILES notation for 2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylacetamide?
The canonical SMILES for 2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylacetamide is CC(=O)N(CC(=O)NC1CCCCC1)c1ccc(Cl)cc1C(F)(F)F.
What is the InChIKey of 2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylacetamide?
The InChIKey is JHPVPDOIMLLKFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20ClF3N2O2/c1-11(24)23(10-16(25)22-13-5-3-2-4-6-13)15-8-7-12(18)9-14(15)17(19,20)21/h7-9,13H,2-6,10H2,1H3,(H,22,25).
What are the key properties of 2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylacetamide?
2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylacetamide has a molecular weight of 376.81 g/mol, XLogP of 4.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-cyclohexylacetamide is sourced from PubChem (CID 113179338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).