2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-2-phenylacetamide

C17H17F3N2O — CID 24664974

IUPAC2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-2-phenylacetamide
SMILESCN(Cc1ccccc1C(F)(F)F)C(C(N)=O)c1ccccc1
InChIInChI=1S/C17H17F3N2O/c1-22(15(16(21)23)12-7-3-2-4-8-12)11-13-9-5-6-10-14(13)17(18,19)20/h2-10,15H,11H2,1H3,(H2,21,23)
InChIKeyUNBPZTADVNKPEJ-UHFFFAOYSA-N
MW322.33 g/mol
LogP3.36
Rot. Bonds5

About 2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-2-phenylacetamide

2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-2-phenylacetamide (PubChem CID 24664974) has the molecular formula C17H17F3N2O and a molecular weight of 322.33 g/mol. Its IUPAC name is 2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-2-phenylacetamide.

Molecular Properties

Compound Name2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-2-phenylacetamide
PubChem CID24664974
Molecular FormulaC17H17F3N2O
Molecular Weight322.33 g/mol
Exact Mass322.13
IUPAC Name2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-2-phenylacetamide
SMILESCN(Cc1ccccc1C(F)(F)F)C(C(N)=O)c1ccccc1
InChIInChI=1S/C17H17F3N2O/c1-22(15(16(21)23)12-7-3-2-4-8-12)11-13-9-5-6-10-14(13)17(18,19)20/h2-10,15H,11H2,1H3,(H2,21,23)
InChIKeyUNBPZTADVNKPEJ-UHFFFAOYSA-N
XLogP3.36
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.33
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide
CID 118246686
2-[(2-chlorophenyl)methyl-methylamino]-2-phenylacetamide
CID 46678627
2-[(2,3-dichlorophenyl)methyl-methylamino]-2-phenylacetamide
CID 24584549
2-[(4-chlorophenyl)sulfonyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-2-phenylacetamide
CID 21075487
(2R)-2-[benzyl(methyl)amino]-2-phenylacetamide;hydrate;hydrochloride
CID 68952302
N-methyl-N-[[2-(trifluoromethyl)phenyl]methyl]propan-2-amine
CID 78821261
(2S)-2-[(5-cyano-2-fluorophenyl)methyl-methylamino]-2-phenylacetamide
CID 37414985
N-methyl-N-[[2-(trifluoromethyl)phenyl]methyl]hydroxylamine
CID 105456996
2-N-methyl-2-N-[[2-(trifluoromethyl)phenyl]methyl]propane-1,2-diamine;hydrochloride
CID 119924718
(2R)-N-(2-fluorophenyl)-2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]propanamide
CID 51932634
1-methyl-1-[[2-(trifluoromethyl)phenyl]methyl]hydrazine
CID 91621520
2-[(4-methoxyphenyl)methyl-methylamino]-2-phenylacetamide
CID 42895030

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-2-phenylacetamide?
The IUPAC name of 2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-2-phenylacetamide (CID 24664974) is 2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-2-phenylacetamide.
What is the SMILES notation for 2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-2-phenylacetamide?
The canonical SMILES for 2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-2-phenylacetamide is CN(Cc1ccccc1C(F)(F)F)C(C(N)=O)c1ccccc1.
What is the InChIKey of 2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-2-phenylacetamide?
The InChIKey is UNBPZTADVNKPEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17F3N2O/c1-22(15(16(21)23)12-7-3-2-4-8-12)11-13-9-5-6-10-14(13)17(18,19)20/h2-10,15H,11H2,1H3,(H2,21,23).
What are the key properties of 2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-2-phenylacetamide?
2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-2-phenylacetamide has a molecular weight of 322.33 g/mol, XLogP of 3.36, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]-2-phenylacetamide is sourced from PubChem (CID 24664974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).