N-methyl-N-[4-(trifluoromethyl)phenyl]acetamide

C10H10F3NO — CID 54753132

IUPACN-methyl-N-[4-(trifluoromethyl)phenyl]acetamide
SMILESCC(=O)N(C)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C10H10F3NO/c1-7(15)14(2)9-5-3-8(4-6-9)10(11,12)13/h3-6H,1-2H3
InChIKeyIXHISLSTEZEBIZ-UHFFFAOYSA-N
MW217.19 g/mol
LogP2.69
Rot. Bonds1

About N-methyl-N-[4-(trifluoromethyl)phenyl]acetamide

N-methyl-N-[4-(trifluoromethyl)phenyl]acetamide (PubChem CID 54753132) has the molecular formula C10H10F3NO and a molecular weight of 217.19 g/mol. Its IUPAC name is N-methyl-N-[4-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[4-(trifluoromethyl)phenyl]acetamide
PubChem CID54753132
Molecular FormulaC10H10F3NO
Molecular Weight217.19 g/mol
Exact Mass217.07
IUPAC NameN-methyl-N-[4-(trifluoromethyl)phenyl]acetamide
SMILESCC(=O)N(C)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C10H10F3NO/c1-7(15)14(2)9-5-3-8(4-6-9)10(11,12)13/h3-6H,1-2H3
InChIKeyIXHISLSTEZEBIZ-UHFFFAOYSA-N
XLogP2.69
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.19
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-methyl-N-[4-(trifluoromethyl)phenyl]acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[4-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of N-methyl-N-[4-(trifluoromethyl)phenyl]acetamide (CID 54753132) is N-methyl-N-[4-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for N-methyl-N-[4-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for N-methyl-N-[4-(trifluoromethyl)phenyl]acetamide is CC(=O)N(C)c1ccc(C(F)(F)F)cc1.
What is the InChIKey of N-methyl-N-[4-(trifluoromethyl)phenyl]acetamide?
The InChIKey is IXHISLSTEZEBIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3NO/c1-7(15)14(2)9-5-3-8(4-6-9)10(11,12)13/h3-6H,1-2H3.
What are the key properties of N-methyl-N-[4-(trifluoromethyl)phenyl]acetamide?
N-methyl-N-[4-(trifluoromethyl)phenyl]acetamide has a molecular weight of 217.19 g/mol, XLogP of 2.69, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[4-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 54753132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).