N-(2,2-diphenylethyl)-2,2,2-trifluoroacetamide

C16H14F3NO — CID 59644379

IUPACN-(2,2-diphenylethyl)-2,2,2-trifluoroacetamide
SMILESO=C(NCC(c1ccccc1)c1ccccc1)C(F)(F)F
InChIInChI=1S/C16H14F3NO/c17-16(18,19)15(21)20-11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14H,11H2,(H,20,21)
InChIKeyAROLBSOPOGMTJW-UHFFFAOYSA-N
MW293.29 g/mol
LogP3.50
Rot. Bonds4

About N-(2,2-diphenylethyl)-2,2,2-trifluoroacetamide

N-(2,2-diphenylethyl)-2,2,2-trifluoroacetamide (PubChem CID 59644379) has the molecular formula C16H14F3NO and a molecular weight of 293.29 g/mol. Its IUPAC name is N-(2,2-diphenylethyl)-2,2,2-trifluoroacetamide.

Molecular Properties

Compound NameN-(2,2-diphenylethyl)-2,2,2-trifluoroacetamide
PubChem CID59644379
Molecular FormulaC16H14F3NO
Molecular Weight293.29 g/mol
Exact Mass293.10
IUPAC NameN-(2,2-diphenylethyl)-2,2,2-trifluoroacetamide
SMILESO=C(NCC(c1ccccc1)c1ccccc1)C(F)(F)F
InChIInChI=1S/C16H14F3NO/c17-16(18,19)15(21)20-11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14H,11H2,(H,20,21)
InChIKeyAROLBSOPOGMTJW-UHFFFAOYSA-N
XLogP3.50
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.29
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,2,2-trifluoro-N-(2-hydroxy-2-phenylethyl)acetamide
CID 11117946
(3R)-3-phenyl-4-[(2,2,2-trifluoroacetyl)amino]butanoic acid
CID 96582816
2,2,2-trifluoro-N-(3-hydroxy-3-phenylpropyl)acetamide
CID 76624652
2,2,2-trifluoro-N-[(2R,3R)-3-hydroxy-2-naphthalen-2-yl-3-phenylpropyl]acetamide
CID 118675704
N-[2-(2,6-diamino-4-pyridinyl)-2-phenylethyl]-2,2-difluoro-2-phenylacetamide
CID 130431732
N,N'-bis(3,3-diphenylpropyl)-2,2,3,3-tetrafluorobutanediamide
CID 4162787
2,2,2-trifluoro-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide
CID 15653812
2,2-dimethyl-N-(2-phenyl-2-pyridin-2-ylethyl)propanamide
CID 16927739
1-(2,2-diphenylethyl)-3-ethylurea
CID 47133841
2,2,3,3,4,4,4-heptafluoro-N-(2-hydroxy-2-phenylethyl)butanamide
CID 3253809
N-[2-(1-benzhydrylazetidin-3-yl)-2-cyanoethyl]-2,2,2-trifluoroacetamide
CID 87890210
N-(2-amino-2-phenylethyl)-2,2-dimethylpropanamide;hydrochloride
CID 119529465

Frequently Asked Questions

What is the IUPAC name of N-(2,2-diphenylethyl)-2,2,2-trifluoroacetamide?
The IUPAC name of N-(2,2-diphenylethyl)-2,2,2-trifluoroacetamide (CID 59644379) is N-(2,2-diphenylethyl)-2,2,2-trifluoroacetamide.
What is the SMILES notation for N-(2,2-diphenylethyl)-2,2,2-trifluoroacetamide?
The canonical SMILES for N-(2,2-diphenylethyl)-2,2,2-trifluoroacetamide is O=C(NCC(c1ccccc1)c1ccccc1)C(F)(F)F.
What is the InChIKey of N-(2,2-diphenylethyl)-2,2,2-trifluoroacetamide?
The InChIKey is AROLBSOPOGMTJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F3NO/c17-16(18,19)15(21)20-11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14H,11H2,(H,20,21).
What are the key properties of N-(2,2-diphenylethyl)-2,2,2-trifluoroacetamide?
N-(2,2-diphenylethyl)-2,2,2-trifluoroacetamide has a molecular weight of 293.29 g/mol, XLogP of 3.50, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-diphenylethyl)-2,2,2-trifluoroacetamide is sourced from PubChem (CID 59644379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).