[2-[(2S)-pyrrolidin-2-yl]phenyl]methanol

C11H15NO — CID 66518247

IUPAC[2-[(2S)-pyrrolidin-2-yl]phenyl]methanol
SMILESOCc1ccccc1[C@@H]1CCCN1
InChIInChI=1S/C11H15NO/c13-8-9-4-1-2-5-10(9)11-6-3-7-12-11/h1-2,4-5,11-13H,3,6-8H2/t11-/m0/s1
InChIKeyDIRPYSXHYYRYHP-NSHDSACASA-N
MW177.25 g/mol
LogP1.60
Rot. Bonds2

About [2-[(2S)-pyrrolidin-2-yl]phenyl]methanol

[2-[(2S)-pyrrolidin-2-yl]phenyl]methanol (PubChem CID 66518247) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is [2-[(2S)-pyrrolidin-2-yl]phenyl]methanol.

Molecular Properties

Compound Name[2-[(2S)-pyrrolidin-2-yl]phenyl]methanol
PubChem CID66518247
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name[2-[(2S)-pyrrolidin-2-yl]phenyl]methanol
SMILESOCc1ccccc1[C@@H]1CCCN1
InChIInChI=1S/C11H15NO/c13-8-9-4-1-2-5-10(9)11-6-3-7-12-11/h1-2,4-5,11-13H,3,6-8H2/t11-/m0/s1
InChIKeyDIRPYSXHYYRYHP-NSHDSACASA-N
XLogP1.60
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(hydroxymethyl)-6-[(2S)-pyrrolidin-2-yl]phenol
CID 55263489
2-[2-(fluoromethyl)phenyl]piperidine
CID 84664975
[4-fluoro-2-[(2R)-pyrrolidin-2-yl]phenyl]methanol
CID 68912942
2-(2-ethylphenyl)azepane;hydrochloride
CID 146193845
2-naphthalen-1-ylpiperidine
CID 4209523
(2R)-2-naphthalen-1-ylpyrrolidine;hydrochloride
CID 154803630
(2S)-2-naphthalen-1-ylazepane
CID 7048283
1-methyl-4-[[2-[(2R)-pyrrolidin-2-yl]phenyl]methyl]piperidine
CID 150704826
1-[(2-piperidin-2-ylphenyl)methyl]piperidine
CID 117400046
2-(2-cyclopentylphenyl)piperidine
CID 115005914
2-[(2R)-pyrrolidin-2-yl]benzenethiol
CID 66518323
2-[(2R)-azetidin-2-yl]-6-(hydroxymethyl)phenol
CID 55263951

Frequently Asked Questions

What is the IUPAC name of [2-[(2S)-pyrrolidin-2-yl]phenyl]methanol?
The IUPAC name of [2-[(2S)-pyrrolidin-2-yl]phenyl]methanol (CID 66518247) is [2-[(2S)-pyrrolidin-2-yl]phenyl]methanol.
What is the SMILES notation for [2-[(2S)-pyrrolidin-2-yl]phenyl]methanol?
The canonical SMILES for [2-[(2S)-pyrrolidin-2-yl]phenyl]methanol is OCc1ccccc1[C@@H]1CCCN1.
What is the InChIKey of [2-[(2S)-pyrrolidin-2-yl]phenyl]methanol?
The InChIKey is DIRPYSXHYYRYHP-NSHDSACASA-N. The full InChI is InChI=1S/C11H15NO/c13-8-9-4-1-2-5-10(9)11-6-3-7-12-11/h1-2,4-5,11-13H,3,6-8H2/t11-/m0/s1.
What are the key properties of [2-[(2S)-pyrrolidin-2-yl]phenyl]methanol?
[2-[(2S)-pyrrolidin-2-yl]phenyl]methanol has a molecular weight of 177.25 g/mol, XLogP of 1.60, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2S)-pyrrolidin-2-yl]phenyl]methanol is sourced from PubChem (CID 66518247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).