2-fluoro-5-[(2S)-piperidin-2-yl]phenol

C11H14FNO — CID 131076447

IUPAC2-fluoro-5-[(2S)-piperidin-2-yl]phenol
SMILESOc1cc([C@@H]2CCCCN2)ccc1F
InChIInChI=1S/C11H14FNO/c12-9-5-4-8(7-11(9)14)10-3-1-2-6-13-10/h4-5,7,10,13-14H,1-3,6H2/t10-/m0/s1
InChIKeyLJDVXDCNUHDWNR-JTQLQIEISA-N
MW195.24 g/mol
LogP2.35
Rot. Bonds1

About 2-fluoro-5-[(2S)-piperidin-2-yl]phenol

2-fluoro-5-[(2S)-piperidin-2-yl]phenol (PubChem CID 131076447) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is 2-fluoro-5-[(2S)-piperidin-2-yl]phenol.

Molecular Properties

Compound Name2-fluoro-5-[(2S)-piperidin-2-yl]phenol
PubChem CID131076447
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name2-fluoro-5-[(2S)-piperidin-2-yl]phenol
SMILESOc1cc([C@@H]2CCCCN2)ccc1F
InChIInChI=1S/C11H14FNO/c12-9-5-4-8(7-11(9)14)10-3-1-2-6-13-10/h4-5,7,10,13-14H,1-3,6H2/t10-/m0/s1
InChIKeyLJDVXDCNUHDWNR-JTQLQIEISA-N
XLogP2.35
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-5-[(2R)-piperidin-2-yl]phenol
CID 130699877
4-[(2S)-pyrrolidin-2-yl]benzene-1,2-diol
CID 66518287
2-(3-ethyl-4-fluorophenyl)pyrrolidine
CID 117284037
2-iodo-4-[(2S)-piperidin-2-yl]phenol
CID 130646263
2-methyl-4-[(2R)-piperidin-2-yl]phenol
CID 131198389
4-piperidin-2-ylphenol
CID 19711202
2-methylsulfonyl-5-piperidin-2-ylphenol
CID 117391593
(2R)-2-[3-(difluoromethyl)-4-fluorophenyl]pyrrolidine
CID 66518805
6-[(2R)-piperidin-2-yl]naphthalen-2-ol
CID 171195375
(2R)-2-(4-chlorophenyl)piperidine;hydrochloride
CID 155903197
2-(3-fluoro-4-propan-2-ylphenyl)piperidine
CID 84788156
2-fluoro-5-pyrrolidin-2-ylbenzoic acid
CID 77131521

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-[(2S)-piperidin-2-yl]phenol?
The IUPAC name of 2-fluoro-5-[(2S)-piperidin-2-yl]phenol (CID 131076447) is 2-fluoro-5-[(2S)-piperidin-2-yl]phenol.
What is the SMILES notation for 2-fluoro-5-[(2S)-piperidin-2-yl]phenol?
The canonical SMILES for 2-fluoro-5-[(2S)-piperidin-2-yl]phenol is Oc1cc([C@@H]2CCCCN2)ccc1F.
What is the InChIKey of 2-fluoro-5-[(2S)-piperidin-2-yl]phenol?
The InChIKey is LJDVXDCNUHDWNR-JTQLQIEISA-N. The full InChI is InChI=1S/C11H14FNO/c12-9-5-4-8(7-11(9)14)10-3-1-2-6-13-10/h4-5,7,10,13-14H,1-3,6H2/t10-/m0/s1.
What are the key properties of 2-fluoro-5-[(2S)-piperidin-2-yl]phenol?
2-fluoro-5-[(2S)-piperidin-2-yl]phenol has a molecular weight of 195.24 g/mol, XLogP of 2.35, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-[(2S)-piperidin-2-yl]phenol is sourced from PubChem (CID 131076447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).