3-(2-hydroxycyclopentyl)cyclobutane-1,2-diol

C9H16O3 — CID 67220416

IUPAC3-(2-hydroxycyclopentyl)cyclobutane-1,2-diol
SMILESOC1CC(C2CCCC2O)C1O
InChIInChI=1S/C9H16O3/c10-7-3-1-2-5(7)6-4-8(11)9(6)12/h5-12H,1-4H2
InChIKeyUFTQHSWPYIXRJF-UHFFFAOYSA-N
MW172.22 g/mol
LogP-0.11
Rot. Bonds1

About 3-(2-hydroxycyclopentyl)cyclobutane-1,2-diol

3-(2-hydroxycyclopentyl)cyclobutane-1,2-diol (PubChem CID 67220416) has the molecular formula C9H16O3 and a molecular weight of 172.22 g/mol. Its IUPAC name is 3-(2-hydroxycyclopentyl)cyclobutane-1,2-diol.

Molecular Properties

Compound Name3-(2-hydroxycyclopentyl)cyclobutane-1,2-diol
PubChem CID67220416
Molecular FormulaC9H16O3
Molecular Weight172.22 g/mol
Exact Mass172.11
IUPAC Name3-(2-hydroxycyclopentyl)cyclobutane-1,2-diol
SMILESOC1CC(C2CCCC2O)C1O
InChIInChI=1S/C9H16O3/c10-7-3-1-2-5(7)6-4-8(11)9(6)12/h5-12H,1-4H2
InChIKeyUFTQHSWPYIXRJF-UHFFFAOYSA-N
XLogP-0.11
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.22
LogP ≤ 5-0.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxycyclopentyl)cyclobutane-1,2-diol?
The IUPAC name of 3-(2-hydroxycyclopentyl)cyclobutane-1,2-diol (CID 67220416) is 3-(2-hydroxycyclopentyl)cyclobutane-1,2-diol.
What is the SMILES notation for 3-(2-hydroxycyclopentyl)cyclobutane-1,2-diol?
The canonical SMILES for 3-(2-hydroxycyclopentyl)cyclobutane-1,2-diol is OC1CC(C2CCCC2O)C1O.
What is the InChIKey of 3-(2-hydroxycyclopentyl)cyclobutane-1,2-diol?
The InChIKey is UFTQHSWPYIXRJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O3/c10-7-3-1-2-5(7)6-4-8(11)9(6)12/h5-12H,1-4H2.
What are the key properties of 3-(2-hydroxycyclopentyl)cyclobutane-1,2-diol?
3-(2-hydroxycyclopentyl)cyclobutane-1,2-diol has a molecular weight of 172.22 g/mol, XLogP of -0.11, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxycyclopentyl)cyclobutane-1,2-diol is sourced from PubChem (CID 67220416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).