1-methyl-5-prop-1-en-2-yl-1H-indene

C13H14 — CID 145472081

IUPAC1-methyl-5-prop-1-en-2-yl-1H-indene
SMILESC=C(C)c1ccc2c(c1)C=CC2C
InChIInChI=1S/C13H14/c1-9(2)11-6-7-13-10(3)4-5-12(13)8-11/h4-8,10H,1H2,2-3H3
InChIKeyDGXLQEHYDJPREN-UHFFFAOYSA-N
MW170.25 g/mol
LogP3.85
Rot. Bonds1

About 1-methyl-5-prop-1-en-2-yl-1H-indene

1-methyl-5-prop-1-en-2-yl-1H-indene (PubChem CID 145472081) has the molecular formula C13H14 and a molecular weight of 170.25 g/mol. Its IUPAC name is 1-methyl-5-prop-1-en-2-yl-1H-indene.

Molecular Properties

Compound Name1-methyl-5-prop-1-en-2-yl-1H-indene
PubChem CID145472081
Molecular FormulaC13H14
Molecular Weight170.25 g/mol
Exact Mass170.11
IUPAC Name1-methyl-5-prop-1-en-2-yl-1H-indene
SMILESC=C(C)c1ccc2c(c1)C=CC2C
InChIInChI=1S/C13H14/c1-9(2)11-6-7-13-10(3)4-5-12(13)8-11/h4-8,10H,1H2,2-3H3
InChIKeyDGXLQEHYDJPREN-UHFFFAOYSA-N
XLogP3.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-prop-1-en-2-yl-1H-indene?
The IUPAC name of 1-methyl-5-prop-1-en-2-yl-1H-indene (CID 145472081) is 1-methyl-5-prop-1-en-2-yl-1H-indene.
What is the SMILES notation for 1-methyl-5-prop-1-en-2-yl-1H-indene?
The canonical SMILES for 1-methyl-5-prop-1-en-2-yl-1H-indene is C=C(C)c1ccc2c(c1)C=CC2C.
What is the InChIKey of 1-methyl-5-prop-1-en-2-yl-1H-indene?
The InChIKey is DGXLQEHYDJPREN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14/c1-9(2)11-6-7-13-10(3)4-5-12(13)8-11/h4-8,10H,1H2,2-3H3.
What are the key properties of 1-methyl-5-prop-1-en-2-yl-1H-indene?
1-methyl-5-prop-1-en-2-yl-1H-indene has a molecular weight of 170.25 g/mol, XLogP of 3.85, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-prop-1-en-2-yl-1H-indene is sourced from PubChem (CID 145472081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).