2-(2-fluorophenyl)-2-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol

C18H20FNO — CID 134282165

IUPAC2-(2-fluorophenyl)-2-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol
SMILESOC(C(c1ccccc1)c1ccccc1F)[C@H]1CCCN1
InChIInChI=1S/C18H20FNO/c19-15-10-5-4-9-14(15)17(13-7-2-1-3-8-13)18(21)16-11-6-12-20-16/h1-5,7-10,16-18,20-21H,6,11-12H2/t16-,17?,18?/m1/s1
InChIKeyNKSLDIYRHWLXIN-WWDZGPRUSA-N
MW285.36 g/mol
LogP3.07
Rot. Bonds4

About 2-(2-fluorophenyl)-2-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol

2-(2-fluorophenyl)-2-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol (PubChem CID 134282165) has the molecular formula C18H20FNO and a molecular weight of 285.36 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-2-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol.

Molecular Properties

Compound Name2-(2-fluorophenyl)-2-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol
PubChem CID134282165
Molecular FormulaC18H20FNO
Molecular Weight285.36 g/mol
Exact Mass285.15
IUPAC Name2-(2-fluorophenyl)-2-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol
SMILESOC(C(c1ccccc1)c1ccccc1F)[C@H]1CCCN1
InChIInChI=1S/C18H20FNO/c19-15-10-5-4-9-14(15)17(13-7-2-1-3-8-13)18(21)16-11-6-12-20-16/h1-5,7-10,16-18,20-21H,6,11-12H2/t16-,17?,18?/m1/s1
InChIKeyNKSLDIYRHWLXIN-WWDZGPRUSA-N
XLogP3.07
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.36
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-diphenyl-1-[(2R)-pyrrolidin-2-yl]ethanol
CID 118229705
2,2-diphenyl-1-pyrrolidin-2-ylethanol
CID 69294076
2,2-diphenyl-1-[(2S)-pyrrolidin-2-yl]ethanol
CID 68647594
phenyl-[(2R)-pyrrolidin-2-yl]methanol;hydrochloride
CID 68687169
(R)-(2,3-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol
CID 148871488
[2-(2,3-difluorophenyl)-2-phenyl-1-[(2R)-pyrrolidin-2-yl]ethyl] methanesulfonate;hydrochloride
CID 155434160
2-(2-fluorophenyl)-2-piperidin-2-ylethanamine
CID 83987267
(2R)-2-[(1R)-1-phenylethyl]pyrrolidine
CID 95732426
(2-methylphenyl)-[(2R)-pyrrolidin-2-yl]methanol
CID 164654197
3-chloro-4-[hydroxy(piperidin-2-yl)methyl]phenol;(2-fluorophenyl)-piperidin-2-ylmethanol
CID 158994486
(R)-(3,4-difluorophenyl)-[(2S)-pyrrolidin-2-yl]methanol
CID 93183518
1,1,5,5-tetraphenyl-2,4-di(piperidin-2-yl)pentan-3-one;hydrochloride
CID 174956576

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-2-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol?
The IUPAC name of 2-(2-fluorophenyl)-2-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol (CID 134282165) is 2-(2-fluorophenyl)-2-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol.
What is the SMILES notation for 2-(2-fluorophenyl)-2-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol?
The canonical SMILES for 2-(2-fluorophenyl)-2-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol is OC(C(c1ccccc1)c1ccccc1F)[C@H]1CCCN1.
What is the InChIKey of 2-(2-fluorophenyl)-2-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol?
The InChIKey is NKSLDIYRHWLXIN-WWDZGPRUSA-N. The full InChI is InChI=1S/C18H20FNO/c19-15-10-5-4-9-14(15)17(13-7-2-1-3-8-13)18(21)16-11-6-12-20-16/h1-5,7-10,16-18,20-21H,6,11-12H2/t16-,17?,18?/m1/s1.
What are the key properties of 2-(2-fluorophenyl)-2-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol?
2-(2-fluorophenyl)-2-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol has a molecular weight of 285.36 g/mol, XLogP of 3.07, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-2-phenyl-1-[(2R)-pyrrolidin-2-yl]ethanol is sourced from PubChem (CID 134282165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).