6-ethyl-3-methoxy-3-methyl-1,2-dihydroindene

C13H18O — CID 163564021

IUPAC6-ethyl-3-methoxy-3-methyl-1,2-dihydroindene
SMILESCCc1ccc2c(c1)CCC2(C)OC
InChIInChI=1S/C13H18O/c1-4-10-5-6-12-11(9-10)7-8-13(12,2)14-3/h5-6,9H,4,7-8H2,1-3H3
InChIKeyFTQTVFUZLNNQLA-UHFFFAOYSA-N
MW190.29 g/mol
LogP3.06
Rot. Bonds2

About 6-ethyl-3-methoxy-3-methyl-1,2-dihydroindene

6-ethyl-3-methoxy-3-methyl-1,2-dihydroindene (PubChem CID 163564021) has the molecular formula C13H18O and a molecular weight of 190.29 g/mol. Its IUPAC name is 6-ethyl-3-methoxy-3-methyl-1,2-dihydroindene.

Molecular Properties

Compound Name6-ethyl-3-methoxy-3-methyl-1,2-dihydroindene
PubChem CID163564021
Molecular FormulaC13H18O
Molecular Weight190.29 g/mol
Exact Mass190.14
IUPAC Name6-ethyl-3-methoxy-3-methyl-1,2-dihydroindene
SMILESCCc1ccc2c(c1)CCC2(C)OC
InChIInChI=1S/C13H18O/c1-4-10-5-6-12-11(9-10)7-8-13(12,2)14-3/h5-6,9H,4,7-8H2,1-3H3
InChIKeyFTQTVFUZLNNQLA-UHFFFAOYSA-N
XLogP3.06
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-3-methoxy-3-methyl-1,2-dihydroindene?
The IUPAC name of 6-ethyl-3-methoxy-3-methyl-1,2-dihydroindene (CID 163564021) is 6-ethyl-3-methoxy-3-methyl-1,2-dihydroindene.
What is the SMILES notation for 6-ethyl-3-methoxy-3-methyl-1,2-dihydroindene?
The canonical SMILES for 6-ethyl-3-methoxy-3-methyl-1,2-dihydroindene is CCc1ccc2c(c1)CCC2(C)OC.
What is the InChIKey of 6-ethyl-3-methoxy-3-methyl-1,2-dihydroindene?
The InChIKey is FTQTVFUZLNNQLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O/c1-4-10-5-6-12-11(9-10)7-8-13(12,2)14-3/h5-6,9H,4,7-8H2,1-3H3.
What are the key properties of 6-ethyl-3-methoxy-3-methyl-1,2-dihydroindene?
6-ethyl-3-methoxy-3-methyl-1,2-dihydroindene has a molecular weight of 190.29 g/mol, XLogP of 3.06, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-3-methoxy-3-methyl-1,2-dihydroindene is sourced from PubChem (CID 163564021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).