(1S,2S)-1,2-dimethyl-2,3-dihydro-1H-inden-5-ol

C11H14O — CID 129379514

IUPAC(1S,2S)-1,2-dimethyl-2,3-dihydro-1H-inden-5-ol
SMILESC[C@@H]1c2ccc(O)cc2C[C@@H]1C
InChIInChI=1S/C11H14O/c1-7-5-9-6-10(12)3-4-11(9)8(7)2/h3-4,6-8,12H,5H2,1-2H3/t7-,8-/m0/s1
InChIKeyABWSMLAWUHYFPX-YUMQZZPRSA-N
MW162.23 g/mol
LogP2.69
Rot. Bonds

About (1S,2S)-1,2-dimethyl-2,3-dihydro-1H-inden-5-ol

(1S,2S)-1,2-dimethyl-2,3-dihydro-1H-inden-5-ol (PubChem CID 129379514) has the molecular formula C11H14O and a molecular weight of 162.23 g/mol. Its IUPAC name is (1S,2S)-1,2-dimethyl-2,3-dihydro-1H-inden-5-ol.

Molecular Properties

Compound Name(1S,2S)-1,2-dimethyl-2,3-dihydro-1H-inden-5-ol
PubChem CID129379514
Molecular FormulaC11H14O
Molecular Weight162.23 g/mol
Exact Mass162.10
IUPAC Name(1S,2S)-1,2-dimethyl-2,3-dihydro-1H-inden-5-ol
SMILESC[C@@H]1c2ccc(O)cc2C[C@@H]1C
InChIInChI=1S/C11H14O/c1-7-5-9-6-10(12)3-4-11(9)8(7)2/h3-4,6-8,12H,5H2,1-2H3/t7-,8-/m0/s1
InChIKeyABWSMLAWUHYFPX-YUMQZZPRSA-N
XLogP2.69
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1S,2R)-2-methyl-1-[(Z)-prop-1-enyl]-2,3-dihydro-1H-inden-5-ol
CID 131238223
7-aminobicyclo[4.2.0]octa-1(6),2,4-trien-3-ol
CID 105427853
(1R,9R)-17-oxatetracyclo[7.7.1.02,7.010,15]heptadeca-2(7),3,5,10(15),11,13-hexaene-5,13-diol
CID 15359812
1,2-dimethyl-5-(2-phenylethyl)-2,3-dihydro-1H-indene
CID 91436521
(1S,2S)-1,2-dimethyl-2,3-dihydro-1H-indene;ethane;methane
CID 157409915
6-hydroxy-1-methyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
CID 22326243
5-tert-butyl-6-methyl-5,6,7,8-tetrahydronaphthalen-2-ol
CID 123939533
(4bS,8aR)-5,6,7,8,8a,9-hexahydro-4bH-fluoren-2-ol
CID 129388444
5,6-diethyl-1,2-dimethyl-2,3-dihydro-1H-indene
CID 58834653
heptane;2-methyl-2,3-dihydro-1H-inden-5-ol
CID 144683949
5,6-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridine;ethane
CID 143036463
1-methyl-1,2,3,4-tetrahydronaphthalene-2,7-diol
CID 115010784

Frequently Asked Questions

What is the IUPAC name of (1S,2S)-1,2-dimethyl-2,3-dihydro-1H-inden-5-ol?
The IUPAC name of (1S,2S)-1,2-dimethyl-2,3-dihydro-1H-inden-5-ol (CID 129379514) is (1S,2S)-1,2-dimethyl-2,3-dihydro-1H-inden-5-ol.
What is the SMILES notation for (1S,2S)-1,2-dimethyl-2,3-dihydro-1H-inden-5-ol?
The canonical SMILES for (1S,2S)-1,2-dimethyl-2,3-dihydro-1H-inden-5-ol is C[C@@H]1c2ccc(O)cc2C[C@@H]1C.
What is the InChIKey of (1S,2S)-1,2-dimethyl-2,3-dihydro-1H-inden-5-ol?
The InChIKey is ABWSMLAWUHYFPX-YUMQZZPRSA-N. The full InChI is InChI=1S/C11H14O/c1-7-5-9-6-10(12)3-4-11(9)8(7)2/h3-4,6-8,12H,5H2,1-2H3/t7-,8-/m0/s1.
What are the key properties of (1S,2S)-1,2-dimethyl-2,3-dihydro-1H-inden-5-ol?
(1S,2S)-1,2-dimethyl-2,3-dihydro-1H-inden-5-ol has a molecular weight of 162.23 g/mol, XLogP of 2.69, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2S)-1,2-dimethyl-2,3-dihydro-1H-inden-5-ol is sourced from PubChem (CID 129379514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).