[4-fluoro-2-[(2R)-pyrrolidin-2-yl]phenyl]methanol

C11H14FNO — CID 68912942

IUPAC[4-fluoro-2-[(2R)-pyrrolidin-2-yl]phenyl]methanol
SMILESOCc1ccc(F)cc1[C@H]1CCCN1
InChIInChI=1S/C11H14FNO/c12-9-4-3-8(7-14)10(6-9)11-2-1-5-13-11/h3-4,6,11,13-14H,1-2,5,7H2/t11-/m1/s1
InChIKeyMMKKZIOOYDVHKU-LLVKDONJSA-N
MW195.24 g/mol
LogP1.74
Rot. Bonds2

About [4-fluoro-2-[(2R)-pyrrolidin-2-yl]phenyl]methanol

[4-fluoro-2-[(2R)-pyrrolidin-2-yl]phenyl]methanol (PubChem CID 68912942) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is [4-fluoro-2-[(2R)-pyrrolidin-2-yl]phenyl]methanol.

Molecular Properties

Compound Name[4-fluoro-2-[(2R)-pyrrolidin-2-yl]phenyl]methanol
PubChem CID68912942
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name[4-fluoro-2-[(2R)-pyrrolidin-2-yl]phenyl]methanol
SMILESOCc1ccc(F)cc1[C@H]1CCCN1
InChIInChI=1S/C11H14FNO/c12-9-4-3-8(7-14)10(6-9)11-2-1-5-13-11/h3-4,6,11,13-14H,1-2,5,7H2/t11-/m1/s1
InChIKeyMMKKZIOOYDVHKU-LLVKDONJSA-N
XLogP1.74
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(2,5-difluorophenyl)pyrrolidine
CID 7176288
4-fluoro-2-pyrrolidin-2-ylphenol
CID 55283497
[2-[(2S)-pyrrolidin-2-yl]phenyl]methanol
CID 66518247
CID 174947937
CID 174947937
[5-fluoro-2-(pyrrolidin-2-ylmethyl)phenyl]methanol
CID 145138522
4-fluoro-2-pyrrolidin-2-ylbenzoic acid
CID 66690944
2-(azepan-2-yl)-5-fluorophenol
CID 107014696
(2R)-2-(2-ethyl-5-fluorophenyl)azetidine
CID 55294534
(2S)-2-(5-fluoro-2-methoxyphenyl)pyrrolidine
CID 55277653
(2S)-2-[4-fluoro-2-(trifluoromethyl)phenyl]pyrrolidine
CID 66519451
2-(2-chloro-4-fluorophenyl)pyrrolidine;hydrochloride
CID 77131964
(2S)-2-(4-fluoro-2-methylphenyl)piperidine
CID 55278633

Frequently Asked Questions

What is the IUPAC name of [4-fluoro-2-[(2R)-pyrrolidin-2-yl]phenyl]methanol?
The IUPAC name of [4-fluoro-2-[(2R)-pyrrolidin-2-yl]phenyl]methanol (CID 68912942) is [4-fluoro-2-[(2R)-pyrrolidin-2-yl]phenyl]methanol.
What is the SMILES notation for [4-fluoro-2-[(2R)-pyrrolidin-2-yl]phenyl]methanol?
The canonical SMILES for [4-fluoro-2-[(2R)-pyrrolidin-2-yl]phenyl]methanol is OCc1ccc(F)cc1[C@H]1CCCN1.
What is the InChIKey of [4-fluoro-2-[(2R)-pyrrolidin-2-yl]phenyl]methanol?
The InChIKey is MMKKZIOOYDVHKU-LLVKDONJSA-N. The full InChI is InChI=1S/C11H14FNO/c12-9-4-3-8(7-14)10(6-9)11-2-1-5-13-11/h3-4,6,11,13-14H,1-2,5,7H2/t11-/m1/s1.
What are the key properties of [4-fluoro-2-[(2R)-pyrrolidin-2-yl]phenyl]methanol?
[4-fluoro-2-[(2R)-pyrrolidin-2-yl]phenyl]methanol has a molecular weight of 195.24 g/mol, XLogP of 1.74, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-fluoro-2-[(2R)-pyrrolidin-2-yl]phenyl]methanol is sourced from PubChem (CID 68912942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).