(2R)-2-phenyl-2-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)acetamide

C14H17F3N2O — CID 94749994

IUPAC(2R)-2-phenyl-2-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(NCC(F)(F)F)[C@@H](c1ccccc1)N1CCCC1
InChIInChI=1S/C14H17F3N2O/c15-14(16,17)10-18-13(20)12(19-8-4-5-9-19)11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H,18,20)/t12-/m1/s1
InChIKeyLIENHOPOMIERCO-GFCCVEGCSA-N
MW286.30 g/mol
LogP2.50
Rot. Bonds4

About (2R)-2-phenyl-2-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)acetamide

(2R)-2-phenyl-2-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 94749994) has the molecular formula C14H17F3N2O and a molecular weight of 286.30 g/mol. Its IUPAC name is (2R)-2-phenyl-2-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name(2R)-2-phenyl-2-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID94749994
Molecular FormulaC14H17F3N2O
Molecular Weight286.30 g/mol
Exact Mass286.13
IUPAC Name(2R)-2-phenyl-2-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(NCC(F)(F)F)[C@@H](c1ccccc1)N1CCCC1
InChIInChI=1S/C14H17F3N2O/c15-14(16,17)10-18-13(20)12(19-8-4-5-9-19)11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H,18,20)/t12-/m1/s1
InChIKeyLIENHOPOMIERCO-GFCCVEGCSA-N
XLogP2.50
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.30
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] (2R)-2-phenyl-2-pyrrolidin-1-ylacetate
CID 95306625
2-phenyl-2-pyrrolidin-1-yl-N-[[2-(trifluoromethoxy)phenyl]methyl]acetamide
CID 56509917
1-[2-(4-fluoroanilino)-2-oxo-1-phenylethyl]-N-(2,2,2-trifluoroethyl)piperidine-4-carboxamide
CID 43062016
(2S)-2-phenyl-2-pyrrolidin-1-yl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]acetamide
CID 52523009
N-(3-cyclopentylpropyl)-2-phenyl-2-pyrrolidin-1-ylacetamide
CID 56510051
(2S)-N-methyl-2-phenyl-2-piperidin-1-ylacetamide
CID 67962694
(2R)-N-(ethylcarbamoyl)-2-phenyl-2-piperidin-1-ylacetamide
CID 26551632
2-(azocan-1-yl)-2-phenylacetamide
CID 42889497
(1R)-3,3-dimethyl-1-phenyl-1-pyrrolidin-1-ylbutan-2-one
CID 59470882
(2R)-2-(4-methylpiperazin-1-yl)-2-phenyl-N-propylacetamide
CID 94820416
2-[[2-(4-methylpiperazin-1-yl)-2-phenylacetyl]amino]acetic acid
CID 119350173
methyl (3R)-3-[[(2S)-2-phenyl-2-pyrrolidin-1-ylacetyl]amino]butanoate
CID 95967811

Frequently Asked Questions

What is the IUPAC name of (2R)-2-phenyl-2-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of (2R)-2-phenyl-2-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)acetamide (CID 94749994) is (2R)-2-phenyl-2-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for (2R)-2-phenyl-2-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for (2R)-2-phenyl-2-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)acetamide is O=C(NCC(F)(F)F)[C@@H](c1ccccc1)N1CCCC1.
What is the InChIKey of (2R)-2-phenyl-2-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is LIENHOPOMIERCO-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H17F3N2O/c15-14(16,17)10-18-13(20)12(19-8-4-5-9-19)11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H,18,20)/t12-/m1/s1.
What are the key properties of (2R)-2-phenyl-2-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)acetamide?
(2R)-2-phenyl-2-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 286.30 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-phenyl-2-pyrrolidin-1-yl-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 94749994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).