(1S,2R)-spiro[1,2-dihydroindene-3,4'-piperidine]-1,2-diol

C13H17NO2 — CID 131859580

IUPAC(1S,2R)-spiro[1,2-dihydroindene-3,4'-piperidine]-1,2-diol
SMILESO[C@H]1c2ccccc2C2(CCNCC2)[C@H]1O
InChIInChI=1S/C13H17NO2/c15-11-9-3-1-2-4-10(9)13(12(11)16)5-7-14-8-6-13/h1-4,11-12,14-16H,5-8H2/t11-,12-/m0/s1
InChIKeyUKJSYEIVCGFUES-RYUDHWBXSA-N
MW219.28 g/mol
LogP0.72
Rot. Bonds

About (1S,2R)-spiro[1,2-dihydroindene-3,4'-piperidine]-1,2-diol

(1S,2R)-spiro[1,2-dihydroindene-3,4'-piperidine]-1,2-diol (PubChem CID 131859580) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is (1S,2R)-spiro[1,2-dihydroindene-3,4'-piperidine]-1,2-diol.

Molecular Properties

Compound Name(1S,2R)-spiro[1,2-dihydroindene-3,4'-piperidine]-1,2-diol
PubChem CID131859580
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC Name(1S,2R)-spiro[1,2-dihydroindene-3,4'-piperidine]-1,2-diol
SMILESO[C@H]1c2ccccc2C2(CCNCC2)[C@H]1O
InChIInChI=1S/C13H17NO2/c15-11-9-3-1-2-4-10(9)13(12(11)16)5-7-14-8-6-13/h1-4,11-12,14-16H,5-8H2/t11-,12-/m0/s1
InChIKeyUKJSYEIVCGFUES-RYUDHWBXSA-N
XLogP0.72
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 50.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(1S,2S)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol
CID 133116592
(1R,2R)-1-morpholin-4-ylspiro[1,2-dihydroindene-3,4'-piperidine]-2-ol
CID 30882023
(1R,2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol
CID 30957280
(1S,2S)-1-[(4-fluorophenyl)methyl-methylamino]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol
CID 133112951
(1S,2S)-1-[4-(aminomethyl)triazol-1-yl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol
CID 133128985
2-(2,6-difluorophenyl)-N-[(1R,2R)-2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 56887275
1-methyl-11-azatricyclo[7.4.1.02,7]tetradeca-2,4,6-trien-8-ol
CID 146840967
(1R,2R)-1-[(3,4-dimethoxyphenyl)methylamino]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol
CID 56896122
(1S,2S)-1-(5,6-dimethylbenzimidazol-1-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol
CID 133128337
2-[4-[(1R,2R)-2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]piperazin-1-yl]benzonitrile
CID 30937418
(1R,2R)-1-[4-(2,2-dimethoxyethyl)piperazin-1-yl]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol
CID 28954987
(1R,2R)-1-[methyl-[(3-methylthiophen-2-yl)methyl]amino]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol
CID 31162599

Frequently Asked Questions

What is the IUPAC name of (1S,2R)-spiro[1,2-dihydroindene-3,4'-piperidine]-1,2-diol?
The IUPAC name of (1S,2R)-spiro[1,2-dihydroindene-3,4'-piperidine]-1,2-diol (CID 131859580) is (1S,2R)-spiro[1,2-dihydroindene-3,4'-piperidine]-1,2-diol.
What is the SMILES notation for (1S,2R)-spiro[1,2-dihydroindene-3,4'-piperidine]-1,2-diol?
The canonical SMILES for (1S,2R)-spiro[1,2-dihydroindene-3,4'-piperidine]-1,2-diol is O[C@H]1c2ccccc2C2(CCNCC2)[C@H]1O.
What is the InChIKey of (1S,2R)-spiro[1,2-dihydroindene-3,4'-piperidine]-1,2-diol?
The InChIKey is UKJSYEIVCGFUES-RYUDHWBXSA-N. The full InChI is InChI=1S/C13H17NO2/c15-11-9-3-1-2-4-10(9)13(12(11)16)5-7-14-8-6-13/h1-4,11-12,14-16H,5-8H2/t11-,12-/m0/s1.
What are the key properties of (1S,2R)-spiro[1,2-dihydroindene-3,4'-piperidine]-1,2-diol?
(1S,2R)-spiro[1,2-dihydroindene-3,4'-piperidine]-1,2-diol has a molecular weight of 219.28 g/mol, XLogP of 0.72, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2R)-spiro[1,2-dihydroindene-3,4'-piperidine]-1,2-diol is sourced from PubChem (CID 131859580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).