(2,6,8-trimethyl-6-tricyclo[5.3.1.01,5]undec-8-enyl)methanol

C15H24O — CID 519545

IUPAC(2,6,8-trimethyl-6-tricyclo[5.3.1.01,5]undec-8-enyl)methanol
SMILESCC1=CCC23CC1C(C)(CO)C2CCC3C
InChIInChI=1S/C15H24O/c1-10-6-7-15-8-12(10)14(3,9-16)13(15)5-4-11(15)2/h6,11-13,16H,4-5,7-9H2,1-3H3
InChIKeyPPTXKCYXNDLKTQ-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.39
Rot. Bonds1

About (2,6,8-trimethyl-6-tricyclo[5.3.1.01,5]undec-8-enyl)methanol

(2,6,8-trimethyl-6-tricyclo[5.3.1.01,5]undec-8-enyl)methanol (PubChem CID 519545) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is (2,6,8-trimethyl-6-tricyclo[5.3.1.01,5]undec-8-enyl)methanol.

Molecular Properties

Compound Name(2,6,8-trimethyl-6-tricyclo[5.3.1.01,5]undec-8-enyl)methanol
PubChem CID519545
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name(2,6,8-trimethyl-6-tricyclo[5.3.1.01,5]undec-8-enyl)methanol
SMILESCC1=CCC23CC1C(C)(CO)C2CCC3C
InChIInChI=1S/C15H24O/c1-10-6-7-15-8-12(10)14(3,9-16)13(15)5-4-11(15)2/h6,11-13,16H,4-5,7-9H2,1-3H3
InChIKeyPPTXKCYXNDLKTQ-UHFFFAOYSA-N
XLogP3.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2,6,8-trimethyl-6-tricyclo[5.3.1.01,5]undec-8-enyl)methanol?
The IUPAC name of (2,6,8-trimethyl-6-tricyclo[5.3.1.01,5]undec-8-enyl)methanol (CID 519545) is (2,6,8-trimethyl-6-tricyclo[5.3.1.01,5]undec-8-enyl)methanol.
What is the SMILES notation for (2,6,8-trimethyl-6-tricyclo[5.3.1.01,5]undec-8-enyl)methanol?
The canonical SMILES for (2,6,8-trimethyl-6-tricyclo[5.3.1.01,5]undec-8-enyl)methanol is CC1=CCC23CC1C(C)(CO)C2CCC3C.
What is the InChIKey of (2,6,8-trimethyl-6-tricyclo[5.3.1.01,5]undec-8-enyl)methanol?
The InChIKey is PPTXKCYXNDLKTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-10-6-7-15-8-12(10)14(3,9-16)13(15)5-4-11(15)2/h6,11-13,16H,4-5,7-9H2,1-3H3.
What are the key properties of (2,6,8-trimethyl-6-tricyclo[5.3.1.01,5]undec-8-enyl)methanol?
(2,6,8-trimethyl-6-tricyclo[5.3.1.01,5]undec-8-enyl)methanol has a molecular weight of 220.36 g/mol, XLogP of 3.39, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6,8-trimethyl-6-tricyclo[5.3.1.01,5]undec-8-enyl)methanol is sourced from PubChem (CID 519545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).