1,2,5-trimethylcyclopentan-1-ol

C8H16O — CID 85132129

IUPAC1,2,5-trimethylcyclopentan-1-ol
SMILESCC1CCC(C)C1(C)O
InChIInChI=1S/C8H16O/c1-6-4-5-7(2)8(6,3)9/h6-7,9H,4-5H2,1-3H3
InChIKeyAKMPYCFDXLJQJS-UHFFFAOYSA-N
MW128.22 g/mol
LogP1.80
Rot. Bonds

About 1,2,5-trimethylcyclopentan-1-ol

1,2,5-trimethylcyclopentan-1-ol (PubChem CID 85132129) has the molecular formula C8H16O and a molecular weight of 128.22 g/mol. Its IUPAC name is 1,2,5-trimethylcyclopentan-1-ol.

Molecular Properties

Compound Name1,2,5-trimethylcyclopentan-1-ol
PubChem CID85132129
Molecular FormulaC8H16O
Molecular Weight128.22 g/mol
Exact Mass128.12
IUPAC Name1,2,5-trimethylcyclopentan-1-ol
SMILESCC1CCC(C)C1(C)O
InChIInChI=1S/C8H16O/c1-6-4-5-7(2)8(6,3)9/h6-7,9H,4-5H2,1-3H3
InChIKeyAKMPYCFDXLJQJS-UHFFFAOYSA-N
XLogP1.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,2,5-trimethylcyclopentan-1-ol?
The IUPAC name of 1,2,5-trimethylcyclopentan-1-ol (CID 85132129) is 1,2,5-trimethylcyclopentan-1-ol.
What is the SMILES notation for 1,2,5-trimethylcyclopentan-1-ol?
The canonical SMILES for 1,2,5-trimethylcyclopentan-1-ol is CC1CCC(C)C1(C)O.
What is the InChIKey of 1,2,5-trimethylcyclopentan-1-ol?
The InChIKey is AKMPYCFDXLJQJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O/c1-6-4-5-7(2)8(6,3)9/h6-7,9H,4-5H2,1-3H3.
What are the key properties of 1,2,5-trimethylcyclopentan-1-ol?
1,2,5-trimethylcyclopentan-1-ol has a molecular weight of 128.22 g/mol, XLogP of 1.80, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,5-trimethylcyclopentan-1-ol is sourced from PubChem (CID 85132129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).