2-[(2R)-piperidin-2-yl]benzene-1,3-diol

C11H15NO2 — CID 130679710

IUPAC2-[(2R)-piperidin-2-yl]benzene-1,3-diol
SMILESOc1cccc(O)c1[C@H]1CCCCN1
InChIInChI=1S/C11H15NO2/c13-9-5-3-6-10(14)11(9)8-4-1-2-7-12-8/h3,5-6,8,12-14H,1-2,4,7H2/t8-/m1/s1
InChIKeyANEOZOTWBSKWPZ-MRVPVSSYSA-N
MW193.25 g/mol
LogP1.91
Rot. Bonds1

About 2-[(2R)-piperidin-2-yl]benzene-1,3-diol

2-[(2R)-piperidin-2-yl]benzene-1,3-diol (PubChem CID 130679710) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-[(2R)-piperidin-2-yl]benzene-1,3-diol.

Molecular Properties

Compound Name2-[(2R)-piperidin-2-yl]benzene-1,3-diol
PubChem CID130679710
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name2-[(2R)-piperidin-2-yl]benzene-1,3-diol
SMILESOc1cccc(O)c1[C@H]1CCCCN1
InChIInChI=1S/C11H15NO2/c13-9-5-3-6-10(14)11(9)8-4-1-2-7-12-8/h3,5-6,8,12-14H,1-2,4,7H2/t8-/m1/s1
InChIKeyANEOZOTWBSKWPZ-MRVPVSSYSA-N
XLogP1.91
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

1-piperidin-2-ylnaphthalen-2-ol
CID 53391922
3-[(2R)-piperidin-2-yl]benzene-1,2-diol
CID 130665742
1-piperidin-2-ylnaphthalen-2-ol;hydrochloride
CID 121000004
3-[(2S)-piperidin-2-yl]benzene-1,2-diol;hydrochloride
CID 171194852
2-chloro-3-piperidin-2-ylphenol
CID 130000735
(2R)-2-(2,6-dimethylphenyl)piperidine;hydrochloride
CID 171195444
4-[(2R)-piperidin-2-yl]naphthalen-1-ol
CID 171195556
3-[(2S)-piperidin-2-yl]phenol
CID 55277853
4-[(2R)-piperidin-2-yl]benzene-1,3-diol;hydrochloride
CID 171195341
4-piperidin-2-ylphenol
CID 19711202
(2S)-2-phenylpiperidine
CID 10997356
(2S)-2-(2-chloro-6-fluorophenyl)piperidine;hydrochloride
CID 171194835

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-piperidin-2-yl]benzene-1,3-diol?
The IUPAC name of 2-[(2R)-piperidin-2-yl]benzene-1,3-diol (CID 130679710) is 2-[(2R)-piperidin-2-yl]benzene-1,3-diol.
What is the SMILES notation for 2-[(2R)-piperidin-2-yl]benzene-1,3-diol?
The canonical SMILES for 2-[(2R)-piperidin-2-yl]benzene-1,3-diol is Oc1cccc(O)c1[C@H]1CCCCN1.
What is the InChIKey of 2-[(2R)-piperidin-2-yl]benzene-1,3-diol?
The InChIKey is ANEOZOTWBSKWPZ-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H15NO2/c13-9-5-3-6-10(14)11(9)8-4-1-2-7-12-8/h3,5-6,8,12-14H,1-2,4,7H2/t8-/m1/s1.
What are the key properties of 2-[(2R)-piperidin-2-yl]benzene-1,3-diol?
2-[(2R)-piperidin-2-yl]benzene-1,3-diol has a molecular weight of 193.25 g/mol, XLogP of 1.91, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-piperidin-2-yl]benzene-1,3-diol is sourced from PubChem (CID 130679710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).