(2S)-1-naphthalen-1-yl-2-(trifluoromethyl)pyrrolidine

C15H14F3N — CID 86337138

IUPAC(2S)-1-naphthalen-1-yl-2-(trifluoromethyl)pyrrolidine
SMILESFC(F)(F)[C@@H]1CCCN1c1cccc2ccccc12
InChIInChI=1S/C15H14F3N/c16-15(17,18)14-9-4-10-19(14)13-8-3-6-11-5-1-2-7-12(11)13/h1-3,5-8,14H,4,9-10H2/t14-/m0/s1
InChIKeyXQXYPQQCTHOHGW-AWEZNQCLSA-N
MW265.28 g/mol
LogP4.37
Rot. Bonds1

About (2S)-1-naphthalen-1-yl-2-(trifluoromethyl)pyrrolidine

(2S)-1-naphthalen-1-yl-2-(trifluoromethyl)pyrrolidine (PubChem CID 86337138) has the molecular formula C15H14F3N and a molecular weight of 265.28 g/mol. Its IUPAC name is (2S)-1-naphthalen-1-yl-2-(trifluoromethyl)pyrrolidine.

Molecular Properties

Compound Name(2S)-1-naphthalen-1-yl-2-(trifluoromethyl)pyrrolidine
PubChem CID86337138
Molecular FormulaC15H14F3N
Molecular Weight265.28 g/mol
Exact Mass265.11
IUPAC Name(2S)-1-naphthalen-1-yl-2-(trifluoromethyl)pyrrolidine
SMILESFC(F)(F)[C@@H]1CCCN1c1cccc2ccccc12
InChIInChI=1S/C15H14F3N/c16-15(17,18)14-9-4-10-19(14)13-8-3-6-11-5-1-2-7-12(11)13/h1-3,5-8,14H,4,9-10H2/t14-/m0/s1
InChIKeyXQXYPQQCTHOHGW-AWEZNQCLSA-N
XLogP4.37
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.28
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (2S)-1-naphthalen-1-yl-2-(trifluoromethyl)pyrrolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-phenyl-2-(trifluoromethyl)pyrrolidine
CID 46193758
2-ethenyl-1-naphthalen-1-ylpyrrolidine
CID 164888024
1-phenyl-2-(trifluoromethyl)piperidine
CID 144718854
[(2S)-1-anthracen-1-ylpyrrolidin-2-yl]methanol
CID 139951713
2-naphthalen-1-yl-4a,5,6,7-tetrahydro-4H-pyrrolo[1,2-c]pyrimidine-1,3-dione
CID 61371935
(2S)-3-hydroxy-1-naphthalen-1-ylpyrrolidine-2-carboxylic acid
CID 67245808
6-[2-[(2S)-2-(trifluoromethyl)pyrrolidin-1-yl]pyrimidin-5-yl]pyridin-2-amine
CID 86727117
2-[1,1,1,3,3,3-hexafluoro-2-(3-naphthalen-1-yl-2,4-dihydro-1,3-benzoxazin-2-yl)propan-2-yl]-3-naphthalen-1-yl-2,4-dihydro-1,3-benzoxazine
CID 141340310
1-(2-fluorophenyl)-2-propylpyrrolidine
CID 67817363
naphthalen-1-yl-[(3R)-3-(trifluoromethyl)piperidin-1-yl]methanone
CID 51556451
4-[2-(trifluoromethyl)pyrrolidin-1-yl]-1,3,5-triazin-2-amine
CID 141350804
[1-[2-(trifluoromethyl)phenyl]pyrrolidin-2-yl]methanamine
CID 62592985

Frequently Asked Questions

What is the IUPAC name of (2S)-1-naphthalen-1-yl-2-(trifluoromethyl)pyrrolidine?
The IUPAC name of (2S)-1-naphthalen-1-yl-2-(trifluoromethyl)pyrrolidine (CID 86337138) is (2S)-1-naphthalen-1-yl-2-(trifluoromethyl)pyrrolidine.
What is the SMILES notation for (2S)-1-naphthalen-1-yl-2-(trifluoromethyl)pyrrolidine?
The canonical SMILES for (2S)-1-naphthalen-1-yl-2-(trifluoromethyl)pyrrolidine is FC(F)(F)[C@@H]1CCCN1c1cccc2ccccc12.
What is the InChIKey of (2S)-1-naphthalen-1-yl-2-(trifluoromethyl)pyrrolidine?
The InChIKey is XQXYPQQCTHOHGW-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H14F3N/c16-15(17,18)14-9-4-10-19(14)13-8-3-6-11-5-1-2-7-12(11)13/h1-3,5-8,14H,4,9-10H2/t14-/m0/s1.
What are the key properties of (2S)-1-naphthalen-1-yl-2-(trifluoromethyl)pyrrolidine?
(2S)-1-naphthalen-1-yl-2-(trifluoromethyl)pyrrolidine has a molecular weight of 265.28 g/mol, XLogP of 4.37, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-naphthalen-1-yl-2-(trifluoromethyl)pyrrolidine is sourced from PubChem (CID 86337138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).