1-methoxy-4,5,6,7-tetrahydro-1H-indene

C10H14O — CID 151591560

IUPAC1-methoxy-4,5,6,7-tetrahydro-1H-indene
SMILESCOC1C=CC2=C1CCCC2
InChIInChI=1S/C10H14O/c1-11-10-7-6-8-4-2-3-5-9(8)10/h6-7,10H,2-5H2,1H3
InChIKeyQIPMQFBJBSCFGG-UHFFFAOYSA-N
MW150.22 g/mol
LogP2.44
Rot. Bonds1

About 1-methoxy-4,5,6,7-tetrahydro-1H-indene

1-methoxy-4,5,6,7-tetrahydro-1H-indene (PubChem CID 151591560) has the molecular formula C10H14O and a molecular weight of 150.22 g/mol. Its IUPAC name is 1-methoxy-4,5,6,7-tetrahydro-1H-indene.

Molecular Properties

Compound Name1-methoxy-4,5,6,7-tetrahydro-1H-indene
PubChem CID151591560
Molecular FormulaC10H14O
Molecular Weight150.22 g/mol
Exact Mass150.10
IUPAC Name1-methoxy-4,5,6,7-tetrahydro-1H-indene
SMILESCOC1C=CC2=C1CCCC2
InChIInChI=1S/C10H14O/c1-11-10-7-6-8-4-2-3-5-9(8)10/h6-7,10H,2-5H2,1H3
InChIKeyQIPMQFBJBSCFGG-UHFFFAOYSA-N
XLogP2.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-4,5,6,7-tetrahydro-1H-indene?
The IUPAC name of 1-methoxy-4,5,6,7-tetrahydro-1H-indene (CID 151591560) is 1-methoxy-4,5,6,7-tetrahydro-1H-indene.
What is the SMILES notation for 1-methoxy-4,5,6,7-tetrahydro-1H-indene?
The canonical SMILES for 1-methoxy-4,5,6,7-tetrahydro-1H-indene is COC1C=CC2=C1CCCC2.
What is the InChIKey of 1-methoxy-4,5,6,7-tetrahydro-1H-indene?
The InChIKey is QIPMQFBJBSCFGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O/c1-11-10-7-6-8-4-2-3-5-9(8)10/h6-7,10H,2-5H2,1H3.
What are the key properties of 1-methoxy-4,5,6,7-tetrahydro-1H-indene?
1-methoxy-4,5,6,7-tetrahydro-1H-indene has a molecular weight of 150.22 g/mol, XLogP of 2.44, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-4,5,6,7-tetrahydro-1H-indene is sourced from PubChem (CID 151591560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).