2-tricyclo[1.1.1.01,3]pentanylmethanol

C6H8O — CID 10975409

IUPAC2-tricyclo[1.1.1.01,3]pentanylmethanol
SMILESOCC1C23CC12C3
InChIInChI=1S/C6H8O/c7-1-4-5-2-6(4,5)3-5/h4,7H,1-3H2
InChIKeyDJXRIRWJHXILBJ-UHFFFAOYSA-N
MW96.13 g/mol
LogP0.39
Rot. Bonds1

About 2-tricyclo[1.1.1.01,3]pentanylmethanol

2-tricyclo[1.1.1.01,3]pentanylmethanol (PubChem CID 10975409) has the molecular formula C6H8O and a molecular weight of 96.13 g/mol. Its IUPAC name is 2-tricyclo[1.1.1.01,3]pentanylmethanol.

Molecular Properties

Compound Name2-tricyclo[1.1.1.01,3]pentanylmethanol
PubChem CID10975409
Molecular FormulaC6H8O
Molecular Weight96.13 g/mol
Exact Mass96.06
IUPAC Name2-tricyclo[1.1.1.01,3]pentanylmethanol
SMILESOCC1C23CC12C3
InChIInChI=1S/C6H8O/c7-1-4-5-2-6(4,5)3-5/h4,7H,1-3H2
InChIKeyDJXRIRWJHXILBJ-UHFFFAOYSA-N
XLogP0.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.13
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-tricyclo[1.1.1.01,3]pentanylmethanol?
The IUPAC name of 2-tricyclo[1.1.1.01,3]pentanylmethanol (CID 10975409) is 2-tricyclo[1.1.1.01,3]pentanylmethanol.
What is the SMILES notation for 2-tricyclo[1.1.1.01,3]pentanylmethanol?
The canonical SMILES for 2-tricyclo[1.1.1.01,3]pentanylmethanol is OCC1C23CC12C3.
What is the InChIKey of 2-tricyclo[1.1.1.01,3]pentanylmethanol?
The InChIKey is DJXRIRWJHXILBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O/c7-1-4-5-2-6(4,5)3-5/h4,7H,1-3H2.
What are the key properties of 2-tricyclo[1.1.1.01,3]pentanylmethanol?
2-tricyclo[1.1.1.01,3]pentanylmethanol has a molecular weight of 96.13 g/mol, XLogP of 0.39, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tricyclo[1.1.1.01,3]pentanylmethanol is sourced from PubChem (CID 10975409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).