1-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1H-indene

C18H18 — CID 173404050

IUPAC1-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1H-indene
SMILESc1ccc2c(c1)CCC2c1ccc2c(c1)CCC2
InChIInChI=1S/C18H18/c1-2-7-17-14(4-1)10-11-18(17)16-9-8-13-5-3-6-15(13)12-16/h1-2,4,7-9,12,18H,3,5-6,10-11H2
InChIKeyBGZKTAGAGVTAHZ-UHFFFAOYSA-N
MW234.34 g/mol
LogP4.25
Rot. Bonds1

About 1-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1H-indene

1-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1H-indene (PubChem CID 173404050) has the molecular formula C18H18 and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1H-indene
PubChem CID173404050
Molecular FormulaC18H18
Molecular Weight234.34 g/mol
Exact Mass234.14
IUPAC Name1-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1H-indene
SMILESc1ccc2c(c1)CCC2c1ccc2c(c1)CCC2
InChIInChI=1S/C18H18/c1-2-7-17-14(4-1)10-11-18(17)16-9-8-13-5-3-6-15(13)12-16/h1-2,4,7-9,12,18H,3,5-6,10-11H2
InChIKeyBGZKTAGAGVTAHZ-UHFFFAOYSA-N
XLogP4.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1H-indene?
The IUPAC name of 1-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1H-indene (CID 173404050) is 1-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1H-indene.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1H-indene?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1H-indene is c1ccc2c(c1)CCC2c1ccc2c(c1)CCC2.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1H-indene?
The InChIKey is BGZKTAGAGVTAHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18/c1-2-7-17-14(4-1)10-11-18(17)16-9-8-13-5-3-6-15(13)12-16/h1-2,4,7-9,12,18H,3,5-6,10-11H2.
What are the key properties of 1-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1H-indene?
1-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1H-indene has a molecular weight of 234.34 g/mol, XLogP of 4.25, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-5-yl)-2,3-dihydro-1H-indene is sourced from PubChem (CID 173404050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).