1,6-dimethyl-2,3-dihydro-1H-inden-5-ol

C11H14O — CID 71371609

IUPAC1,6-dimethyl-2,3-dihydro-1H-inden-5-ol
SMILESCc1cc2c(cc1O)CCC2C
InChIInChI=1S/C11H14O/c1-7-3-4-9-6-11(12)8(2)5-10(7)9/h5-7,12H,3-4H2,1-2H3
InChIKeyVPPXEGFGEKWKQW-UHFFFAOYSA-N
MW162.23 g/mol
LogP2.75
Rot. Bonds

About 1,6-dimethyl-2,3-dihydro-1H-inden-5-ol

1,6-dimethyl-2,3-dihydro-1H-inden-5-ol (PubChem CID 71371609) has the molecular formula C11H14O and a molecular weight of 162.23 g/mol. Its IUPAC name is 1,6-dimethyl-2,3-dihydro-1H-inden-5-ol.

Molecular Properties

Compound Name1,6-dimethyl-2,3-dihydro-1H-inden-5-ol
PubChem CID71371609
Molecular FormulaC11H14O
Molecular Weight162.23 g/mol
Exact Mass162.10
IUPAC Name1,6-dimethyl-2,3-dihydro-1H-inden-5-ol
SMILESCc1cc2c(cc1O)CCC2C
InChIInChI=1S/C11H14O/c1-7-3-4-9-6-11(12)8(2)5-10(7)9/h5-7,12H,3-4H2,1-2H3
InChIKeyVPPXEGFGEKWKQW-UHFFFAOYSA-N
XLogP2.75
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 ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,6-dimethyl-2,3-dihydro-1H-inden-5-ol?
The IUPAC name of 1,6-dimethyl-2,3-dihydro-1H-inden-5-ol (CID 71371609) is 1,6-dimethyl-2,3-dihydro-1H-inden-5-ol.
What is the SMILES notation for 1,6-dimethyl-2,3-dihydro-1H-inden-5-ol?
The canonical SMILES for 1,6-dimethyl-2,3-dihydro-1H-inden-5-ol is Cc1cc2c(cc1O)CCC2C.
What is the InChIKey of 1,6-dimethyl-2,3-dihydro-1H-inden-5-ol?
The InChIKey is VPPXEGFGEKWKQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O/c1-7-3-4-9-6-11(12)8(2)5-10(7)9/h5-7,12H,3-4H2,1-2H3.
What are the key properties of 1,6-dimethyl-2,3-dihydro-1H-inden-5-ol?
1,6-dimethyl-2,3-dihydro-1H-inden-5-ol has a molecular weight of 162.23 g/mol, XLogP of 2.75, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-dimethyl-2,3-dihydro-1H-inden-5-ol is sourced from PubChem (CID 71371609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).