1,7-dimethoxy-2,3-dihydro-1H-indene

C11H14O2 — CID 139893728

IUPAC1,7-dimethoxy-2,3-dihydro-1H-indene
SMILESCOc1cccc2c1C(OC)CC2
InChIInChI=1S/C11H14O2/c1-12-9-5-3-4-8-6-7-10(13-2)11(8)9/h3-5,10H,6-7H2,1-2H3
InChIKeyVNAYMPDBYNNEEL-UHFFFAOYSA-N
MW178.23 g/mol
LogP2.33
Rot. Bonds2

About 1,7-dimethoxy-2,3-dihydro-1H-indene

1,7-dimethoxy-2,3-dihydro-1H-indene (PubChem CID 139893728) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is 1,7-dimethoxy-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name1,7-dimethoxy-2,3-dihydro-1H-indene
PubChem CID139893728
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name1,7-dimethoxy-2,3-dihydro-1H-indene
SMILESCOc1cccc2c1C(OC)CC2
InChIInChI=1S/C11H14O2/c1-12-9-5-3-4-8-6-7-10(13-2)11(8)9/h3-5,10H,6-7H2,1-2H3
InChIKeyVNAYMPDBYNNEEL-UHFFFAOYSA-N
XLogP2.33
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(7-methoxy-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine
CID 105474790
(4aS)-10-methoxy-1,2,3,4,4a,5,6,10b-octahydrobenzo[f]quinoline
CID 58294423
(1S)-8-methoxy-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine;hydrochloride
CID 142637843
4-methoxy-5,6,7,8,9,10-hexahydrobenzo[8]annulene
CID 153201426
(3S)-5-methoxy-16-methyltricyclo[10.4.0.04,9]hexadeca-1(16),4(9),5,7,12,14-hexaene-2,3-diol
CID 158553914
(2S)-8-methoxy-2-methyl-1,2,3,4-tetrahydronaphthalene
CID 67639312
[3-[(E)-(2,6-dimethoxyphenyl)methylideneamino]oxy-2,3-dihydro-1H-inden-4-yl] acetate
CID 177453131
1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-methylmethanamine
CID 105458034
N-(4-aminocyclohexyl)-7-methoxy-N-methyl-2,3-dihydro-1H-indene-1-carboxamide
CID 154577939
(2-benzyl-8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 23364201
1,8-dimethoxy-9,10-dihydroanthracene-9,10-diol
CID 12651971
1,3-dimethoxy-2-(2-methylcyclopentyl)benzene
CID 118593665

Frequently Asked Questions

What is the IUPAC name of 1,7-dimethoxy-2,3-dihydro-1H-indene?
The IUPAC name of 1,7-dimethoxy-2,3-dihydro-1H-indene (CID 139893728) is 1,7-dimethoxy-2,3-dihydro-1H-indene.
What is the SMILES notation for 1,7-dimethoxy-2,3-dihydro-1H-indene?
The canonical SMILES for 1,7-dimethoxy-2,3-dihydro-1H-indene is COc1cccc2c1C(OC)CC2.
What is the InChIKey of 1,7-dimethoxy-2,3-dihydro-1H-indene?
The InChIKey is VNAYMPDBYNNEEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O2/c1-12-9-5-3-4-8-6-7-10(13-2)11(8)9/h3-5,10H,6-7H2,1-2H3.
What are the key properties of 1,7-dimethoxy-2,3-dihydro-1H-indene?
1,7-dimethoxy-2,3-dihydro-1H-indene has a molecular weight of 178.23 g/mol, XLogP of 2.33, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,7-dimethoxy-2,3-dihydro-1H-indene is sourced from PubChem (CID 139893728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).