2-pyrrolidin-1-yl-N-(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)acetamide

C21H23F3N2O — CID 21277904

IUPAC2-pyrrolidin-1-yl-N-(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)acetamide
SMILESO=C(CN1CCCC1)NC(Cc1ccccc1)(c1ccccc1)C(F)(F)F
InChIInChI=1S/C21H23F3N2O/c22-21(23,24)20(18-11-5-2-6-12-18,15-17-9-3-1-4-10-17)25-19(27)16-26-13-7-8-14-26/h1-6,9-12H,7-8,13-16H2,(H,25,27)
InChIKeyYNPGTXBERWVOSZ-UHFFFAOYSA-N
MW376.42 g/mol
LogP3.90
Rot. Bonds6

About 2-pyrrolidin-1-yl-N-(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)acetamide

2-pyrrolidin-1-yl-N-(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)acetamide (PubChem CID 21277904) has the molecular formula C21H23F3N2O and a molecular weight of 376.42 g/mol. Its IUPAC name is 2-pyrrolidin-1-yl-N-(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)acetamide.

Molecular Properties

Compound Name2-pyrrolidin-1-yl-N-(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)acetamide
PubChem CID21277904
Molecular FormulaC21H23F3N2O
Molecular Weight376.42 g/mol
Exact Mass376.18
IUPAC Name2-pyrrolidin-1-yl-N-(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)acetamide
SMILESO=C(CN1CCCC1)NC(Cc1ccccc1)(c1ccccc1)C(F)(F)F
InChIInChI=1S/C21H23F3N2O/c22-21(23,24)20(18-11-5-2-6-12-18,15-17-9-3-1-4-10-17)25-19(27)16-26-13-7-8-14-26/h1-6,9-12H,7-8,13-16H2,(H,25,27)
InChIKeyYNPGTXBERWVOSZ-UHFFFAOYSA-N
XLogP3.90
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.42
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(Z)-but-2-enedioic acid;2-(dimethylamino)-N-(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)acetamide
CID 70393278
2-(4-benzyl-1,4-diazepan-1-yl)-N-[3,5-bis(trifluoromethyl)phenyl]acetamide
CID 16608496
2-(azocan-1-yl)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 8583773
N-(1,2-diphenylpropan-2-yl)pyrrolidine-1-carboxamide
CID 67926030
bis[1-amino-2-oxo-2-[(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)amino]ethyl] (Z)-but-2-enedioate
CID 88630700
N-(phenylcarbamoyl)-2-[4-[[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepan-1-yl]acetamide
CID 24618129
1,2-diphenyl-3-(piperidin-1-ylmethyl)but-3-en-2-ol;hydrochloride
CID 159545866
N-(2-methylbutan-2-yl)-2-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]acetamide
CID 18088722
benzyl 2-(azetidin-1-yl)acetate
CID 140980014
2-(4-benzylpiperazin-1-yl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]acetamide
CID 30863248
bis[1-(dimethylamino)-2-oxo-2-[(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)amino]ethyl] (Z)-but-2-enedioate
CID 88631089
1-(azepan-1-yl)-3-phenylpropan-2-one
CID 43794492

Frequently Asked Questions

What is the IUPAC name of 2-pyrrolidin-1-yl-N-(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)acetamide?
The IUPAC name of 2-pyrrolidin-1-yl-N-(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)acetamide (CID 21277904) is 2-pyrrolidin-1-yl-N-(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)acetamide.
What is the SMILES notation for 2-pyrrolidin-1-yl-N-(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)acetamide?
The canonical SMILES for 2-pyrrolidin-1-yl-N-(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)acetamide is O=C(CN1CCCC1)NC(Cc1ccccc1)(c1ccccc1)C(F)(F)F.
What is the InChIKey of 2-pyrrolidin-1-yl-N-(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)acetamide?
The InChIKey is YNPGTXBERWVOSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23F3N2O/c22-21(23,24)20(18-11-5-2-6-12-18,15-17-9-3-1-4-10-17)25-19(27)16-26-13-7-8-14-26/h1-6,9-12H,7-8,13-16H2,(H,25,27).
What are the key properties of 2-pyrrolidin-1-yl-N-(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)acetamide?
2-pyrrolidin-1-yl-N-(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)acetamide has a molecular weight of 376.42 g/mol, XLogP of 3.90, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrrolidin-1-yl-N-(1,1,1-trifluoro-2,3-diphenylpropan-2-yl)acetamide is sourced from PubChem (CID 21277904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).