1,5-dimethoxy-2,2-dimethyl-1,3-dihydroindene

C13H18O2 — CID 10398076

IUPAC1,5-dimethoxy-2,2-dimethyl-1,3-dihydroindene
SMILESCOc1ccc2c(c1)CC(C)(C)C2OC
InChIInChI=1S/C13H18O2/c1-13(2)8-9-7-10(14-3)5-6-11(9)12(13)15-4/h5-7,12H,8H2,1-4H3
InChIKeyIUIQDHXYPMLCDS-UHFFFAOYSA-N
MW206.28 g/mol
LogP2.96
Rot. Bonds2

About 1,5-dimethoxy-2,2-dimethyl-1,3-dihydroindene

1,5-dimethoxy-2,2-dimethyl-1,3-dihydroindene (PubChem CID 10398076) has the molecular formula C13H18O2 and a molecular weight of 206.28 g/mol. Its IUPAC name is 1,5-dimethoxy-2,2-dimethyl-1,3-dihydroindene.

Molecular Properties

Compound Name1,5-dimethoxy-2,2-dimethyl-1,3-dihydroindene
PubChem CID10398076
Molecular FormulaC13H18O2
Molecular Weight206.28 g/mol
Exact Mass206.13
IUPAC Name1,5-dimethoxy-2,2-dimethyl-1,3-dihydroindene
SMILESCOc1ccc2c(c1)CC(C)(C)C2OC
InChIInChI=1S/C13H18O2/c1-13(2)8-9-7-10(14-3)5-6-11(9)12(13)15-4/h5-7,12H,8H2,1-4H3
InChIKeyIUIQDHXYPMLCDS-UHFFFAOYSA-N
XLogP2.96
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-methoxy-3,3-dimethyl-2,4-dihydro-1H-naphthalen-1-amine
CID 84620622
6-methoxy-2,2-dimethyl-1,3-dihydroinden-1-ol
CID 10035482
(1R)-6-methoxy-2,2-dimethyl-1,3-dihydroinden-1-ol
CID 132506381
(1R,2R)-2-(hydroxymethyl)-5-methoxy-2-methyl-1,3-dihydroinden-1-ol
CID 56945780
2-(2,2-dimethylcyclopropyl)-5-methoxyaniline
CID 121014201
(2R)-2-bromo-6-methoxy-3,3-dimethyl-2,4-dihydronaphthalen-1-one
CID 124560116
[6-fluoro-5-(2-fluoro-4-methoxyphenyl)-2,2-dimethyl-1,3-dihydroinden-1-yl] carbamate
CID 175296812
5-methoxy-2-methyl-1,3-dihydroinden-2-amine
CID 84717968
6-methoxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline
CID 64687418
(1R,3R)-6-methoxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline
CID 96722646
(3Z,3aS,9bR)-3-ethylidene-7-methoxy-3a-methyl-2,4,5,9b-tetrahydro-1H-cyclopenta[a]naphthalene
CID 10999207
4,7-dimethoxy-3,4-dihydro-1H-isochromene
CID 14530781

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethoxy-2,2-dimethyl-1,3-dihydroindene?
The IUPAC name of 1,5-dimethoxy-2,2-dimethyl-1,3-dihydroindene (CID 10398076) is 1,5-dimethoxy-2,2-dimethyl-1,3-dihydroindene.
What is the SMILES notation for 1,5-dimethoxy-2,2-dimethyl-1,3-dihydroindene?
The canonical SMILES for 1,5-dimethoxy-2,2-dimethyl-1,3-dihydroindene is COc1ccc2c(c1)CC(C)(C)C2OC.
What is the InChIKey of 1,5-dimethoxy-2,2-dimethyl-1,3-dihydroindene?
The InChIKey is IUIQDHXYPMLCDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2/c1-13(2)8-9-7-10(14-3)5-6-11(9)12(13)15-4/h5-7,12H,8H2,1-4H3.
What are the key properties of 1,5-dimethoxy-2,2-dimethyl-1,3-dihydroindene?
1,5-dimethoxy-2,2-dimethyl-1,3-dihydroindene has a molecular weight of 206.28 g/mol, XLogP of 2.96, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethoxy-2,2-dimethyl-1,3-dihydroindene is sourced from PubChem (CID 10398076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).