5-methoxy-6,7-dihydro-1H-indene

C10H12O — CID 57039017

IUPAC5-methoxy-6,7-dihydro-1H-indene
SMILESCOC1=CC2=C(CC=C2)CC1
InChIInChI=1S/C10H12O/c1-11-10-6-5-8-3-2-4-9(8)7-10/h2,4,7H,3,5-6H2,1H3
InChIKeyJUVOHDGJZGAPEZ-UHFFFAOYSA-N
MW148.20 g/mol
LogP2.57
Rot. Bonds1

About 5-methoxy-6,7-dihydro-1H-indene

5-methoxy-6,7-dihydro-1H-indene (PubChem CID 57039017) has the molecular formula C10H12O and a molecular weight of 148.20 g/mol. Its IUPAC name is 5-methoxy-6,7-dihydro-1H-indene.

Molecular Properties

Compound Name5-methoxy-6,7-dihydro-1H-indene
PubChem CID57039017
Molecular FormulaC10H12O
Molecular Weight148.20 g/mol
Exact Mass148.09
IUPAC Name5-methoxy-6,7-dihydro-1H-indene
SMILESCOC1=CC2=C(CC=C2)CC1
InChIInChI=1S/C10H12O/c1-11-10-6-5-8-3-2-4-9(8)7-10/h2,4,7H,3,5-6H2,1H3
InChIKeyJUVOHDGJZGAPEZ-UHFFFAOYSA-N
XLogP2.57
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.20
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-6,7-dihydro-1H-indene?
The IUPAC name of 5-methoxy-6,7-dihydro-1H-indene (CID 57039017) is 5-methoxy-6,7-dihydro-1H-indene.
What is the SMILES notation for 5-methoxy-6,7-dihydro-1H-indene?
The canonical SMILES for 5-methoxy-6,7-dihydro-1H-indene is COC1=CC2=C(CC=C2)CC1.
What is the InChIKey of 5-methoxy-6,7-dihydro-1H-indene?
The InChIKey is JUVOHDGJZGAPEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O/c1-11-10-6-5-8-3-2-4-9(8)7-10/h2,4,7H,3,5-6H2,1H3.
What are the key properties of 5-methoxy-6,7-dihydro-1H-indene?
5-methoxy-6,7-dihydro-1H-indene has a molecular weight of 148.20 g/mol, XLogP of 2.57, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-6,7-dihydro-1H-indene is sourced from PubChem (CID 57039017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).