1,4,4,7-tetramethyltricyclo[5.3.1.02,6]undecan-11-ol

C15H26O — CID 521185

IUPAC1,4,4,7-tetramethyltricyclo[5.3.1.02,6]undecan-11-ol
SMILESCC1(C)CC2C(C1)C1(C)CCCC2(C)C1O
InChIInChI=1S/C15H26O/c1-13(2)8-10-11(9-13)15(4)7-5-6-14(10,3)12(15)16/h10-12,16H,5-9H2,1-4H3
InChIKeyMJYUBUQHKCAJQR-UHFFFAOYSA-N
MW222.37 g/mol
LogP3.61
Rot. Bonds

About 1,4,4,7-tetramethyltricyclo[5.3.1.02,6]undecan-11-ol

1,4,4,7-tetramethyltricyclo[5.3.1.02,6]undecan-11-ol (PubChem CID 521185) has the molecular formula C15H26O and a molecular weight of 222.37 g/mol. Its IUPAC name is 1,4,4,7-tetramethyltricyclo[5.3.1.02,6]undecan-11-ol.

Molecular Properties

Compound Name1,4,4,7-tetramethyltricyclo[5.3.1.02,6]undecan-11-ol
PubChem CID521185
Molecular FormulaC15H26O
Molecular Weight222.37 g/mol
Exact Mass222.20
IUPAC Name1,4,4,7-tetramethyltricyclo[5.3.1.02,6]undecan-11-ol
SMILESCC1(C)CC2C(C1)C1(C)CCCC2(C)C1O
InChIInChI=1S/C15H26O/c1-13(2)8-10-11(9-13)15(4)7-5-6-14(10,3)12(15)16/h10-12,16H,5-9H2,1-4H3
InChIKeyMJYUBUQHKCAJQR-UHFFFAOYSA-N
XLogP3.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.37
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,4,4,7-tetramethyltricyclo[5.3.1.02,6]undecan-11-ol?
The IUPAC name of 1,4,4,7-tetramethyltricyclo[5.3.1.02,6]undecan-11-ol (CID 521185) is 1,4,4,7-tetramethyltricyclo[5.3.1.02,6]undecan-11-ol.
What is the SMILES notation for 1,4,4,7-tetramethyltricyclo[5.3.1.02,6]undecan-11-ol?
The canonical SMILES for 1,4,4,7-tetramethyltricyclo[5.3.1.02,6]undecan-11-ol is CC1(C)CC2C(C1)C1(C)CCCC2(C)C1O.
What is the InChIKey of 1,4,4,7-tetramethyltricyclo[5.3.1.02,6]undecan-11-ol?
The InChIKey is MJYUBUQHKCAJQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O/c1-13(2)8-10-11(9-13)15(4)7-5-6-14(10,3)12(15)16/h10-12,16H,5-9H2,1-4H3.
What are the key properties of 1,4,4,7-tetramethyltricyclo[5.3.1.02,6]undecan-11-ol?
1,4,4,7-tetramethyltricyclo[5.3.1.02,6]undecan-11-ol has a molecular weight of 222.37 g/mol, XLogP of 3.61, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,4,7-tetramethyltricyclo[5.3.1.02,6]undecan-11-ol is sourced from PubChem (CID 521185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).