(2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine

C17H18FN — CID 134966567

IUPAC(2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine
SMILESFc1ccc(C[C@H]2CCCN2c2ccccc2)cc1
InChIInChI=1S/C17H18FN/c18-15-10-8-14(9-11-15)13-17-7-4-12-19(17)16-5-2-1-3-6-16/h1-3,5-6,8-11,17H,4,7,12-13H2/t17-/m1/s1
InChIKeyJIFOKHBUQDKYAO-QGZVFWFLSA-N
MW255.34 g/mol
LogP4.04
Rot. Bonds3

About (2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine

(2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine (PubChem CID 134966567) has the molecular formula C17H18FN and a molecular weight of 255.34 g/mol. Its IUPAC name is (2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine.

Molecular Properties

Compound Name(2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine
PubChem CID134966567
Molecular FormulaC17H18FN
Molecular Weight255.34 g/mol
Exact Mass255.14
IUPAC Name(2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine
SMILESFc1ccc(C[C@H]2CCCN2c2ccccc2)cc1
InChIInChI=1S/C17H18FN/c18-15-10-8-14(9-11-15)13-17-7-4-12-19(17)16-5-2-1-3-6-16/h1-3,5-6,8-11,17H,4,7,12-13H2/t17-/m1/s1
InChIKeyJIFOKHBUQDKYAO-QGZVFWFLSA-N
XLogP4.04
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine?
The IUPAC name of (2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine (CID 134966567) is (2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine.
What is the SMILES notation for (2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine?
The canonical SMILES for (2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine is Fc1ccc(C[C@H]2CCCN2c2ccccc2)cc1.
What is the InChIKey of (2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine?
The InChIKey is JIFOKHBUQDKYAO-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H18FN/c18-15-10-8-14(9-11-15)13-17-7-4-12-19(17)16-5-2-1-3-6-16/h1-3,5-6,8-11,17H,4,7,12-13H2/t17-/m1/s1.
What are the key properties of (2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine?
(2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine has a molecular weight of 255.34 g/mol, XLogP of 4.04, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine is sourced from PubChem (CID 134966567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).