2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide

C11H13F3N2O — CID 21383101

IUPAC2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide
SMILESCN(C)CC(=O)Nc1ccccc1C(F)(F)F
InChIInChI=1S/C11H13F3N2O/c1-16(2)7-10(17)15-9-6-4-3-5-8(9)11(12,13)14/h3-6H,7H2,1-2H3,(H,15,17)
InChIKeyBTHVQUROWYLBAH-UHFFFAOYSA-N
MW246.23 g/mol
LogP2.21
Rot. Bonds3

About 2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide

2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide (PubChem CID 21383101) has the molecular formula C11H13F3N2O and a molecular weight of 246.23 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide
PubChem CID21383101
Molecular FormulaC11H13F3N2O
Molecular Weight246.23 g/mol
Exact Mass246.10
IUPAC Name2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide
SMILESCN(C)CC(=O)Nc1ccccc1C(F)(F)F
InChIInChI=1S/C11H13F3N2O/c1-16(2)7-10(17)15-9-6-4-3-5-8(9)11(12,13)14/h3-6H,7H2,1-2H3,(H,15,17)
InChIKeyBTHVQUROWYLBAH-UHFFFAOYSA-N
XLogP2.21
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.23
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-chloroacetyl)-methylamino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 2095781
2-[methyl-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]amino]propanoic acid
CID 119913712
N-ethyl-N-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]-2-(trifluoromethyl)benzamide
CID 26356947
2-[methyl-(4-methylcyclohexyl)amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 51226770
methyl N-[2-[methyl-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]amino]acetyl]carbamate
CID 9286444
2-[methyl-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]amino]-N-(2-phenylphenyl)acetamide
CID 17427414
2-chloro-N-methyl-N-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]benzamide
CID 18112781
2-[(2-bromophenyl)methyl-methylamino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 26600898
2-[methyl-[2-(N-methylanilino)-2-oxoethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 16566193
N-methyl-N-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]-3,3-diphenylpropanamide
CID 26897747
2-[[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]-propan-2-ylamino]acetamide
CID 40760123
2-[acetyl(cyclopentyl)amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 113159346

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide (CID 21383101) is 2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide is CN(C)CC(=O)Nc1ccccc1C(F)(F)F.
What is the InChIKey of 2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide?
The InChIKey is BTHVQUROWYLBAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F3N2O/c1-16(2)7-10(17)15-9-6-4-3-5-8(9)11(12,13)14/h3-6H,7H2,1-2H3,(H,15,17).
What are the key properties of 2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide?
2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide has a molecular weight of 246.23 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 21383101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).