2,6-di(cyclopenten-1-yl)-4-methylphenol

C17H20O — CID 154162102

IUPAC2,6-di(cyclopenten-1-yl)-4-methylphenol
SMILESCc1cc(C2=CCCC2)c(O)c(C2=CCCC2)c1
InChIInChI=1S/C17H20O/c1-12-10-15(13-6-2-3-7-13)17(18)16(11-12)14-8-4-5-9-14/h6,8,10-11,18H,2-5,7,9H2,1H3
InChIKeyFXOGMUMZWHQORB-UHFFFAOYSA-N
MW240.35 g/mol
LogP4.84
Rot. Bonds2

About 2,6-di(cyclopenten-1-yl)-4-methylphenol

2,6-di(cyclopenten-1-yl)-4-methylphenol (PubChem CID 154162102) has the molecular formula C17H20O and a molecular weight of 240.35 g/mol. Its IUPAC name is 2,6-di(cyclopenten-1-yl)-4-methylphenol.

Molecular Properties

Compound Name2,6-di(cyclopenten-1-yl)-4-methylphenol
PubChem CID154162102
Molecular FormulaC17H20O
Molecular Weight240.35 g/mol
Exact Mass240.15
IUPAC Name2,6-di(cyclopenten-1-yl)-4-methylphenol
SMILESCc1cc(C2=CCCC2)c(O)c(C2=CCCC2)c1
InChIInChI=1S/C17H20O/c1-12-10-15(13-6-2-3-7-13)17(18)16(11-12)14-8-4-5-9-14/h6,8,10-11,18H,2-5,7,9H2,1H3
InChIKeyFXOGMUMZWHQORB-UHFFFAOYSA-N
XLogP4.84
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,6-di(cyclopenten-1-yl)-4-methylphenol?
The IUPAC name of 2,6-di(cyclopenten-1-yl)-4-methylphenol (CID 154162102) is 2,6-di(cyclopenten-1-yl)-4-methylphenol.
What is the SMILES notation for 2,6-di(cyclopenten-1-yl)-4-methylphenol?
The canonical SMILES for 2,6-di(cyclopenten-1-yl)-4-methylphenol is Cc1cc(C2=CCCC2)c(O)c(C2=CCCC2)c1.
What is the InChIKey of 2,6-di(cyclopenten-1-yl)-4-methylphenol?
The InChIKey is FXOGMUMZWHQORB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O/c1-12-10-15(13-6-2-3-7-13)17(18)16(11-12)14-8-4-5-9-14/h6,8,10-11,18H,2-5,7,9H2,1H3.
What are the key properties of 2,6-di(cyclopenten-1-yl)-4-methylphenol?
2,6-di(cyclopenten-1-yl)-4-methylphenol has a molecular weight of 240.35 g/mol, XLogP of 4.84, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-di(cyclopenten-1-yl)-4-methylphenol is sourced from PubChem (CID 154162102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).