[(2R)-1-[3-(3-fluorophenyl)propyl]pyrrolidin-2-yl]methanol

C14H20FNO — CID 110008287

IUPAC[(2R)-1-[3-(3-fluorophenyl)propyl]pyrrolidin-2-yl]methanol
SMILESOC[C@H]1CCCN1CCCc1cccc(F)c1
InChIInChI=1S/C14H20FNO/c15-13-6-1-4-12(10-13)5-2-8-16-9-3-7-14(16)11-17/h1,4,6,10,14,17H,2-3,5,7-9,11H2/t14-/m1/s1
InChIKeyOZEFPQQZTXMDGR-CQSZACIVSA-N
MW237.32 g/mol
LogP2.21
Rot. Bonds5

About [(2R)-1-[3-(3-fluorophenyl)propyl]pyrrolidin-2-yl]methanol

[(2R)-1-[3-(3-fluorophenyl)propyl]pyrrolidin-2-yl]methanol (PubChem CID 110008287) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is [(2R)-1-[3-(3-fluorophenyl)propyl]pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-1-[3-(3-fluorophenyl)propyl]pyrrolidin-2-yl]methanol
PubChem CID110008287
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name[(2R)-1-[3-(3-fluorophenyl)propyl]pyrrolidin-2-yl]methanol
SMILESOC[C@H]1CCCN1CCCc1cccc(F)c1
InChIInChI=1S/C14H20FNO/c15-13-6-1-4-12(10-13)5-2-8-16-9-3-7-14(16)11-17/h1,4,6,10,14,17H,2-3,5,7-9,11H2/t14-/m1/s1
InChIKeyOZEFPQQZTXMDGR-CQSZACIVSA-N
XLogP2.21
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(2R)-1-[3-(3-fluorophenyl)propyl]pyrrolidin-2-yl]methanol?
The IUPAC name of [(2R)-1-[3-(3-fluorophenyl)propyl]pyrrolidin-2-yl]methanol (CID 110008287) is [(2R)-1-[3-(3-fluorophenyl)propyl]pyrrolidin-2-yl]methanol.
What is the SMILES notation for [(2R)-1-[3-(3-fluorophenyl)propyl]pyrrolidin-2-yl]methanol?
The canonical SMILES for [(2R)-1-[3-(3-fluorophenyl)propyl]pyrrolidin-2-yl]methanol is OC[C@H]1CCCN1CCCc1cccc(F)c1.
What is the InChIKey of [(2R)-1-[3-(3-fluorophenyl)propyl]pyrrolidin-2-yl]methanol?
The InChIKey is OZEFPQQZTXMDGR-CQSZACIVSA-N. The full InChI is InChI=1S/C14H20FNO/c15-13-6-1-4-12(10-13)5-2-8-16-9-3-7-14(16)11-17/h1,4,6,10,14,17H,2-3,5,7-9,11H2/t14-/m1/s1.
What are the key properties of [(2R)-1-[3-(3-fluorophenyl)propyl]pyrrolidin-2-yl]methanol?
[(2R)-1-[3-(3-fluorophenyl)propyl]pyrrolidin-2-yl]methanol has a molecular weight of 237.32 g/mol, XLogP of 2.21, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-[3-(3-fluorophenyl)propyl]pyrrolidin-2-yl]methanol is sourced from PubChem (CID 110008287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).