(3S)-3-[(2-fluorophenyl)methoxy]pyrrolidine

C11H14FNO — CID 66520009

IUPAC(3S)-3-[(2-fluorophenyl)methoxy]pyrrolidine
SMILESFc1ccccc1CO[C@H]1CCNC1
InChIInChI=1S/C11H14FNO/c12-11-4-2-1-3-9(11)8-14-10-5-6-13-7-10/h1-4,10,13H,5-8H2/t10-/m0/s1
InChIKeyJZSIQXJACPTWNP-JTQLQIEISA-N
MW195.24 g/mol
LogP1.70
Rot. Bonds3

About (3S)-3-[(2-fluorophenyl)methoxy]pyrrolidine

(3S)-3-[(2-fluorophenyl)methoxy]pyrrolidine (PubChem CID 66520009) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is (3S)-3-[(2-fluorophenyl)methoxy]pyrrolidine.

Molecular Properties

Compound Name(3S)-3-[(2-fluorophenyl)methoxy]pyrrolidine
PubChem CID66520009
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name(3S)-3-[(2-fluorophenyl)methoxy]pyrrolidine
SMILESFc1ccccc1CO[C@H]1CCNC1
InChIInChI=1S/C11H14FNO/c12-11-4-2-1-3-9(11)8-14-10-5-6-13-7-10/h1-4,10,13H,5-8H2/t10-/m0/s1
InChIKeyJZSIQXJACPTWNP-JTQLQIEISA-N
XLogP1.70
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(2-fluorophenyl)methoxy]pyrrolidine
CID 14497371
3-[(2,4-difluorophenyl)methoxy]pyrrolidine
CID 56831227
(E)-but-2-enedioic acid;(3R)-3-[[2-(2-fluorophenyl)phenyl]methoxy]pyrrolidine
CID 68927708
3-fluoro-4-(pyrrolidin-3-yloxymethyl)benzonitrile
CID 62327906
2-(2,4-difluorophenyl)-3-(pyrrolidin-3-yloxymethyl)pyridine
CID 68927938
3-[[2-(4-methylphenyl)phenyl]methoxy]pyrrolidine
CID 68921724
but-2-enedioic acid;(3R)-3-[[2-(2,4-difluorophenyl)phenyl]methoxy]pyrrolidine
CID 68921762
3-[[2-(4-methylphenyl)phenyl]methoxy]pyrrolidine;hydrochloride
CID 68921723
2-(3,4-difluorophenyl)-3-(pyrrolidin-3-yloxymethyl)pyridine
CID 68924816
3-[(2-fluorophenyl)methoxymethyl]piperidine
CID 56831009
2-[4-fluoro-2-[[(3S)-pyrrolidin-3-yl]oxymethyl]phenyl]phenol
CID 68923378
2-[4-fluoro-2-(pyrrolidin-3-yloxymethyl)phenyl]phenol
CID 68923382

Frequently Asked Questions

What is the IUPAC name of (3S)-3-[(2-fluorophenyl)methoxy]pyrrolidine?
The IUPAC name of (3S)-3-[(2-fluorophenyl)methoxy]pyrrolidine (CID 66520009) is (3S)-3-[(2-fluorophenyl)methoxy]pyrrolidine.
What is the SMILES notation for (3S)-3-[(2-fluorophenyl)methoxy]pyrrolidine?
The canonical SMILES for (3S)-3-[(2-fluorophenyl)methoxy]pyrrolidine is Fc1ccccc1CO[C@H]1CCNC1.
What is the InChIKey of (3S)-3-[(2-fluorophenyl)methoxy]pyrrolidine?
The InChIKey is JZSIQXJACPTWNP-JTQLQIEISA-N. The full InChI is InChI=1S/C11H14FNO/c12-11-4-2-1-3-9(11)8-14-10-5-6-13-7-10/h1-4,10,13H,5-8H2/t10-/m0/s1.
What are the key properties of (3S)-3-[(2-fluorophenyl)methoxy]pyrrolidine?
(3S)-3-[(2-fluorophenyl)methoxy]pyrrolidine has a molecular weight of 195.24 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-[(2-fluorophenyl)methoxy]pyrrolidine is sourced from PubChem (CID 66520009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).