4-cyclohexyl-1-methoxy-1H-indene

C16H20O — CID 150576803

IUPAC4-cyclohexyl-1-methoxy-1H-indene
SMILESCOC1C=Cc2c(C3CCCCC3)cccc21
InChIInChI=1S/C16H20O/c1-17-16-11-10-14-13(8-5-9-15(14)16)12-6-3-2-4-7-12/h5,8-12,16H,2-4,6-7H2,1H3
InChIKeyIMZIZPRUBCVFMT-UHFFFAOYSA-N
MW228.34 g/mol
LogP4.45
Rot. Bonds2

About 4-cyclohexyl-1-methoxy-1H-indene

4-cyclohexyl-1-methoxy-1H-indene (PubChem CID 150576803) has the molecular formula C16H20O and a molecular weight of 228.34 g/mol. Its IUPAC name is 4-cyclohexyl-1-methoxy-1H-indene.

Molecular Properties

Compound Name4-cyclohexyl-1-methoxy-1H-indene
PubChem CID150576803
Molecular FormulaC16H20O
Molecular Weight228.34 g/mol
Exact Mass228.15
IUPAC Name4-cyclohexyl-1-methoxy-1H-indene
SMILESCOC1C=Cc2c(C3CCCCC3)cccc21
InChIInChI=1S/C16H20O/c1-17-16-11-10-14-13(8-5-9-15(14)16)12-6-3-2-4-7-12/h5,8-12,16H,2-4,6-7H2,1H3
InChIKeyIMZIZPRUBCVFMT-UHFFFAOYSA-N
XLogP4.45
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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1,3-bis(2,6-dicyclohexylphenyl)-2H-imidazole
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2-cyclododecylphenol
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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-1-methoxy-1H-indene?
The IUPAC name of 4-cyclohexyl-1-methoxy-1H-indene (CID 150576803) is 4-cyclohexyl-1-methoxy-1H-indene.
What is the SMILES notation for 4-cyclohexyl-1-methoxy-1H-indene?
The canonical SMILES for 4-cyclohexyl-1-methoxy-1H-indene is COC1C=Cc2c(C3CCCCC3)cccc21.
What is the InChIKey of 4-cyclohexyl-1-methoxy-1H-indene?
The InChIKey is IMZIZPRUBCVFMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20O/c1-17-16-11-10-14-13(8-5-9-15(14)16)12-6-3-2-4-7-12/h5,8-12,16H,2-4,6-7H2,1H3.
What are the key properties of 4-cyclohexyl-1-methoxy-1H-indene?
4-cyclohexyl-1-methoxy-1H-indene has a molecular weight of 228.34 g/mol, XLogP of 4.45, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-1-methoxy-1H-indene is sourced from PubChem (CID 150576803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).