(2R)-4,4-difluoro-2-(4-fluorophenyl)pyrrolidine

C10H10F3N — CID 159819312

IUPAC(2R)-4,4-difluoro-2-(4-fluorophenyl)pyrrolidine
SMILESFc1ccc([C@H]2CC(F)(F)CN2)cc1
InChIInChI=1S/C10H10F3N/c11-8-3-1-7(2-4-8)9-5-10(12,13)6-14-9/h1-4,9,14H,5-6H2/t9-/m1/s1
InChIKeyOMHKIFMJBHEIPI-SECBINFHSA-N
MW201.19 g/mol
LogP2.50
Rot. Bonds1

About (2R)-4,4-difluoro-2-(4-fluorophenyl)pyrrolidine

(2R)-4,4-difluoro-2-(4-fluorophenyl)pyrrolidine (PubChem CID 159819312) has the molecular formula C10H10F3N and a molecular weight of 201.19 g/mol. Its IUPAC name is (2R)-4,4-difluoro-2-(4-fluorophenyl)pyrrolidine.

Molecular Properties

Compound Name(2R)-4,4-difluoro-2-(4-fluorophenyl)pyrrolidine
PubChem CID159819312
Molecular FormulaC10H10F3N
Molecular Weight201.19 g/mol
Exact Mass201.08
IUPAC Name(2R)-4,4-difluoro-2-(4-fluorophenyl)pyrrolidine
SMILESFc1ccc([C@H]2CC(F)(F)CN2)cc1
InChIInChI=1S/C10H10F3N/c11-8-3-1-7(2-4-8)9-5-10(12,13)6-14-9/h1-4,9,14H,5-6H2/t9-/m1/s1
InChIKeyOMHKIFMJBHEIPI-SECBINFHSA-N
XLogP2.50
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.19
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-4,4-difluoro-2-(4-fluorophenyl)pyrrolidine?
The IUPAC name of (2R)-4,4-difluoro-2-(4-fluorophenyl)pyrrolidine (CID 159819312) is (2R)-4,4-difluoro-2-(4-fluorophenyl)pyrrolidine.
What is the SMILES notation for (2R)-4,4-difluoro-2-(4-fluorophenyl)pyrrolidine?
The canonical SMILES for (2R)-4,4-difluoro-2-(4-fluorophenyl)pyrrolidine is Fc1ccc([C@H]2CC(F)(F)CN2)cc1.
What is the InChIKey of (2R)-4,4-difluoro-2-(4-fluorophenyl)pyrrolidine?
The InChIKey is OMHKIFMJBHEIPI-SECBINFHSA-N. The full InChI is InChI=1S/C10H10F3N/c11-8-3-1-7(2-4-8)9-5-10(12,13)6-14-9/h1-4,9,14H,5-6H2/t9-/m1/s1.
What are the key properties of (2R)-4,4-difluoro-2-(4-fluorophenyl)pyrrolidine?
(2R)-4,4-difluoro-2-(4-fluorophenyl)pyrrolidine has a molecular weight of 201.19 g/mol, XLogP of 2.50, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4,4-difluoro-2-(4-fluorophenyl)pyrrolidine is sourced from PubChem (CID 159819312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).