6-methoxy-1-methyl-3-methylidene-2H-inden-1-ol

C12H14O2 — CID 102335151

IUPAC6-methoxy-1-methyl-3-methylidene-2H-inden-1-ol
SMILESC=C1CC(C)(O)c2cc(OC)ccc21
InChIInChI=1S/C12H14O2/c1-8-7-12(2,13)11-6-9(14-3)4-5-10(8)11/h4-6,13H,1,7H2,2-3H3
InChIKeyVXAJYXQDSFXYPZ-UHFFFAOYSA-N
MW190.24 g/mol
LogP2.32
Rot. Bonds1

About 6-methoxy-1-methyl-3-methylidene-2H-inden-1-ol

6-methoxy-1-methyl-3-methylidene-2H-inden-1-ol (PubChem CID 102335151) has the molecular formula C12H14O2 and a molecular weight of 190.24 g/mol. Its IUPAC name is 6-methoxy-1-methyl-3-methylidene-2H-inden-1-ol.

Molecular Properties

Compound Name6-methoxy-1-methyl-3-methylidene-2H-inden-1-ol
PubChem CID102335151
Molecular FormulaC12H14O2
Molecular Weight190.24 g/mol
Exact Mass190.10
IUPAC Name6-methoxy-1-methyl-3-methylidene-2H-inden-1-ol
SMILESC=C1CC(C)(O)c2cc(OC)ccc21
InChIInChI=1S/C12H14O2/c1-8-7-12(2,13)11-6-9(14-3)4-5-10(8)11/h4-6,13H,1,7H2,2-3H3
InChIKeyVXAJYXQDSFXYPZ-UHFFFAOYSA-N
XLogP2.32
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-1-methyl-3-methylidene-2H-inden-1-ol?
The IUPAC name of 6-methoxy-1-methyl-3-methylidene-2H-inden-1-ol (CID 102335151) is 6-methoxy-1-methyl-3-methylidene-2H-inden-1-ol.
What is the SMILES notation for 6-methoxy-1-methyl-3-methylidene-2H-inden-1-ol?
The canonical SMILES for 6-methoxy-1-methyl-3-methylidene-2H-inden-1-ol is C=C1CC(C)(O)c2cc(OC)ccc21.
What is the InChIKey of 6-methoxy-1-methyl-3-methylidene-2H-inden-1-ol?
The InChIKey is VXAJYXQDSFXYPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O2/c1-8-7-12(2,13)11-6-9(14-3)4-5-10(8)11/h4-6,13H,1,7H2,2-3H3.
What are the key properties of 6-methoxy-1-methyl-3-methylidene-2H-inden-1-ol?
6-methoxy-1-methyl-3-methylidene-2H-inden-1-ol has a molecular weight of 190.24 g/mol, XLogP of 2.32, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-1-methyl-3-methylidene-2H-inden-1-ol is sourced from PubChem (CID 102335151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).