3-(3H-inden-1-yl)-1H-indene

C18H14 — CID 3402343

IUPAC3-(3H-inden-1-yl)-1H-indene
SMILESC1=C(C2=CCc3ccccc32)c2ccccc2C1
InChIInChI=1S/C18H14/c1-3-7-15-13(5-1)9-11-17(15)18-12-10-14-6-2-4-8-16(14)18/h1-8,11-12H,9-10H2
InChIKeyWUCGLJIGGDJNCY-UHFFFAOYSA-N
MW230.31 g/mol
LogP4.27
Rot. Bonds1

About 3-(3H-inden-1-yl)-1H-indene

3-(3H-inden-1-yl)-1H-indene (PubChem CID 3402343) has the molecular formula C18H14 and a molecular weight of 230.31 g/mol. Its IUPAC name is 3-(3H-inden-1-yl)-1H-indene.

Molecular Properties

Compound Name3-(3H-inden-1-yl)-1H-indene
PubChem CID3402343
Molecular FormulaC18H14
Molecular Weight230.31 g/mol
Exact Mass230.11
IUPAC Name3-(3H-inden-1-yl)-1H-indene
SMILESC1=C(C2=CCc3ccccc32)c2ccccc2C1
InChIInChI=1S/C18H14/c1-3-7-15-13(5-1)9-11-17(15)18-12-10-14-6-2-4-8-16(14)18/h1-8,11-12H,9-10H2
InChIKeyWUCGLJIGGDJNCY-UHFFFAOYSA-N
XLogP4.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 3-(3H-inden-1-yl)-1H-indene?
The IUPAC name of 3-(3H-inden-1-yl)-1H-indene (CID 3402343) is 3-(3H-inden-1-yl)-1H-indene.
What is the SMILES notation for 3-(3H-inden-1-yl)-1H-indene?
The canonical SMILES for 3-(3H-inden-1-yl)-1H-indene is C1=C(C2=CCc3ccccc32)c2ccccc2C1.
What is the InChIKey of 3-(3H-inden-1-yl)-1H-indene?
The InChIKey is WUCGLJIGGDJNCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14/c1-3-7-15-13(5-1)9-11-17(15)18-12-10-14-6-2-4-8-16(14)18/h1-8,11-12H,9-10H2.
What are the key properties of 3-(3H-inden-1-yl)-1H-indene?
3-(3H-inden-1-yl)-1H-indene has a molecular weight of 230.31 g/mol, XLogP of 4.27, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3H-inden-1-yl)-1H-indene is sourced from PubChem (CID 3402343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).