1-cyclohexyl-1H-indene

C15H18 — CID 13380096

IUPAC1-cyclohexyl-1H-indene
SMILESC1=CC(C2CCCCC2)c2ccccc21
InChIInChI=1S/C15H18/c1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)15/h4-5,8-12,15H,1-3,6-7H2
InChIKeyVWZGLCZEBUOTGW-UHFFFAOYSA-N
MW198.31 g/mol
LogP4.38
Rot. Bonds1

About 1-cyclohexyl-1H-indene

1-cyclohexyl-1H-indene (PubChem CID 13380096) has the molecular formula C15H18 and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-cyclohexyl-1H-indene.

Molecular Properties

Compound Name1-cyclohexyl-1H-indene
PubChem CID13380096
Molecular FormulaC15H18
Molecular Weight198.31 g/mol
Exact Mass198.14
IUPAC Name1-cyclohexyl-1H-indene
SMILESC1=CC(C2CCCCC2)c2ccccc21
InChIInChI=1S/C15H18/c1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)15/h4-5,8-12,15H,1-3,6-7H2
InChIKeyVWZGLCZEBUOTGW-UHFFFAOYSA-N
XLogP4.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-1H-indene?
The IUPAC name of 1-cyclohexyl-1H-indene (CID 13380096) is 1-cyclohexyl-1H-indene.
What is the SMILES notation for 1-cyclohexyl-1H-indene?
The canonical SMILES for 1-cyclohexyl-1H-indene is C1=CC(C2CCCCC2)c2ccccc21.
What is the InChIKey of 1-cyclohexyl-1H-indene?
The InChIKey is VWZGLCZEBUOTGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18/c1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)15/h4-5,8-12,15H,1-3,6-7H2.
What are the key properties of 1-cyclohexyl-1H-indene?
1-cyclohexyl-1H-indene has a molecular weight of 198.31 g/mol, XLogP of 4.38, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-1H-indene is sourced from PubChem (CID 13380096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).