2,3-dihydro-1H-indene;methane

C11H18 — CID 158581717

IUPAC2,3-dihydro-1H-indene;methane
SMILESC.C.c1ccc2c(c1)CCC2
InChIInChI=1S/C9H10.2CH4/c1-2-5-9-7-3-6-8(9)4-1;;/h1-2,4-5H,3,6-7H2;2*1H4
InChIKeyHTIFRRHTCXAYDF-UHFFFAOYSA-N
MW150.26 g/mol
LogP3.45
Rot. Bonds

About 2,3-dihydro-1H-indene;methane

2,3-dihydro-1H-indene;methane (PubChem CID 158581717) has the molecular formula C11H18 and a molecular weight of 150.26 g/mol. Its IUPAC name is 2,3-dihydro-1H-indene;methane.

Molecular Properties

Compound Name2,3-dihydro-1H-indene;methane
PubChem CID158581717
Molecular FormulaC11H18
Molecular Weight150.26 g/mol
Exact Mass150.14
IUPAC Name2,3-dihydro-1H-indene;methane
SMILESC.C.c1ccc2c(c1)CCC2
InChIInChI=1S/C9H10.2CH4/c1-2-5-9-7-3-6-8(9)4-1;;/h1-2,4-5H,3,6-7H2;2*1H4
InChIKeyHTIFRRHTCXAYDF-UHFFFAOYSA-N
XLogP3.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.26
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-indene;methane?
The IUPAC name of 2,3-dihydro-1H-indene;methane (CID 158581717) is 2,3-dihydro-1H-indene;methane.
What is the SMILES notation for 2,3-dihydro-1H-indene;methane?
The canonical SMILES for 2,3-dihydro-1H-indene;methane is C.C.c1ccc2c(c1)CCC2.
What is the InChIKey of 2,3-dihydro-1H-indene;methane?
The InChIKey is HTIFRRHTCXAYDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10.2CH4/c1-2-5-9-7-3-6-8(9)4-1;;/h1-2,4-5H,3,6-7H2;2*1H4.
What are the key properties of 2,3-dihydro-1H-indene;methane?
2,3-dihydro-1H-indene;methane has a molecular weight of 150.26 g/mol, XLogP of 3.45, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-indene;methane is sourced from PubChem (CID 158581717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).