N-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]acetamide

C11H12F3NO — CID 11128137

IUPACN-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]acetamide
SMILESCC(=O)N[C@H](C)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C11H12F3NO/c1-7(15-8(2)16)9-3-5-10(6-4-9)11(12,13)14/h3-7H,1-2H3,(H,15,16)/t7-/m1/s1
InChIKeyTZTFQNVEGWEGCC-SSDOTTSWSA-N
MW231.22 g/mol
LogP2.90
Rot. Bonds2

About N-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]acetamide

N-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]acetamide (PubChem CID 11128137) has the molecular formula C11H12F3NO and a molecular weight of 231.22 g/mol. Its IUPAC name is N-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]acetamide.

Molecular Properties

Compound NameN-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]acetamide
PubChem CID11128137
Molecular FormulaC11H12F3NO
Molecular Weight231.22 g/mol
Exact Mass231.09
IUPAC NameN-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]acetamide
SMILESCC(=O)N[C@H](C)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C11H12F3NO/c1-7(15-8(2)16)9-3-5-10(6-4-9)11(12,13)14/h3-7H,1-2H3,(H,15,16)/t7-/m1/s1
InChIKeyTZTFQNVEGWEGCC-SSDOTTSWSA-N
XLogP2.90
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.22
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]acetamide 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

N-(2-phenylethyl)acetamide
CID 70143
Melinamide
CID 20054967
Acetylamphetamine
CID 26660
N-Benzylacetamide
CID 11500
N-(1-Methyl-3-phenylpropyl)acetamide
CID 541808
Get-73
CID 10221200
N-(2-Phenylethyl)propanamide
CID 94894
N-Benzylacrylamide
CID 139428
N-(4-fluorobenzyl)pentanamide
CID 1741622
(2E)-3-phenyl-N-(1-phenylethyl)prop-2-enamide
CID 5720182
2-(Diethylamino)-N-(1-phenylethyl)ethanimidic acid
CID 209462
2-chloro-N-(3-methyl-1-phenylbutyl)acetamide
CID 4962018

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]acetamide?
The IUPAC name of N-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]acetamide (CID 11128137) is N-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]acetamide.
What is the SMILES notation for N-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]acetamide?
The canonical SMILES for N-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]acetamide is CC(=O)N[C@H](C)c1ccc(C(F)(F)F)cc1.
What is the InChIKey of N-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]acetamide?
The InChIKey is TZTFQNVEGWEGCC-SSDOTTSWSA-N. The full InChI is InChI=1S/C11H12F3NO/c1-7(15-8(2)16)9-3-5-10(6-4-9)11(12,13)14/h3-7H,1-2H3,(H,15,16)/t7-/m1/s1.
What are the key properties of N-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]acetamide?
N-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]acetamide has a molecular weight of 231.22 g/mol, XLogP of 2.90, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]acetamide is sourced from PubChem (CID 11128137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).