(1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol

C10H12O2 — CID 10535021

IUPAC(1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol
SMILESCC1[C@@H](O)c2ccccc2[C@@H]1O
InChIInChI=1S/C10H12O2/c1-6-9(11)7-4-2-3-5-8(7)10(6)12/h2-6,9-12H,1H3/t9-,10-/m1/s1
InChIKeyKJHCTFXEVMECKA-NXEZZACHSA-N
MW164.20 g/mol
LogP1.40
Rot. Bonds

About (1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol

(1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol (PubChem CID 10535021) has the molecular formula C10H12O2 and a molecular weight of 164.20 g/mol. Its IUPAC name is (1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol.

Molecular Properties

Compound Name(1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol
PubChem CID10535021
Molecular FormulaC10H12O2
Molecular Weight164.20 g/mol
Exact Mass164.08
IUPAC Name(1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol
SMILESCC1[C@@H](O)c2ccccc2[C@@H]1O
InChIInChI=1S/C10H12O2/c1-6-9(11)7-4-2-3-5-8(7)10(6)12/h2-6,9-12H,1H3/t9-,10-/m1/s1
InChIKeyKJHCTFXEVMECKA-NXEZZACHSA-N
XLogP1.40
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

8-methylbicyclo[4.2.0]octa-1,3,5-trien-7-ol
CID 12561909
(1S,3R)-1,2,3-trimethyl-2,3-dihydro-1H-indene
CID 58834632
(1R,2S,3S,4R)-2,3-dibromo-1,2,3,4-tetrahydronaphthalene-1,4-diol
CID 12740385
(15S,17R)-15,17-dimethyltetracyclo[6.6.3.02,7.09,14]heptadeca-2,4,6,9,11,13-hexaen-16-ol
CID 10515770
7,8-dimethylbicyclo[4.2.0]octa-1,3,5-triene;ethane
CID 159809006
(1S,3S)-2-chloro-2,3-dihydro-1H-indene-1,3-diol
CID 10511719
1-ethyl-3-methyl-1,2,3,4-tetrahydroisoquinolin-4-ol
CID 83967471
6,7-dimethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ol
CID 79725685
2-[(1R,2S,3S)-3-hydroxy-2-methyl-2,3-dihydro-1H-inden-1-yl]-2-isocyanoacetonitrile
CID 59289986
(1S,2S)-2,4-dimethyl-1,2-dihydronaphthalen-1-ol
CID 102230606
4-fluoro-2,3-dimethyl-2,3-dihydro-1H-inden-1-ol
CID 79726794
2-[ethyl(methyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115419992

Frequently Asked Questions

What is the IUPAC name of (1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol?
The IUPAC name of (1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol (CID 10535021) is (1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol.
What is the SMILES notation for (1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol?
The canonical SMILES for (1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol is CC1[C@@H](O)c2ccccc2[C@@H]1O.
What is the InChIKey of (1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol?
The InChIKey is KJHCTFXEVMECKA-NXEZZACHSA-N. The full InChI is InChI=1S/C10H12O2/c1-6-9(11)7-4-2-3-5-8(7)10(6)12/h2-6,9-12H,1H3/t9-,10-/m1/s1.
What are the key properties of (1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol?
(1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol has a molecular weight of 164.20 g/mol, XLogP of 1.40, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,3R)-2-methyl-2,3-dihydro-1H-indene-1,3-diol is sourced from PubChem (CID 10535021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).