5-cyclopentyl-2-(hydroxymethyl)oxolan-3-ol

C10H18O3 — CID 167299642

IUPAC5-cyclopentyl-2-(hydroxymethyl)oxolan-3-ol
SMILESOCC1OC(C2CCCC2)CC1O
InChIInChI=1S/C10H18O3/c11-6-10-8(12)5-9(13-10)7-3-1-2-4-7/h7-12H,1-6H2
InChIKeyQCOGPUZIYNROKM-UHFFFAOYSA-N
MW186.25 g/mol
LogP0.69
Rot. Bonds2

About 5-cyclopentyl-2-(hydroxymethyl)oxolan-3-ol

5-cyclopentyl-2-(hydroxymethyl)oxolan-3-ol (PubChem CID 167299642) has the molecular formula C10H18O3 and a molecular weight of 186.25 g/mol. Its IUPAC name is 5-cyclopentyl-2-(hydroxymethyl)oxolan-3-ol.

Molecular Properties

Compound Name5-cyclopentyl-2-(hydroxymethyl)oxolan-3-ol
PubChem CID167299642
Molecular FormulaC10H18O3
Molecular Weight186.25 g/mol
Exact Mass186.13
IUPAC Name5-cyclopentyl-2-(hydroxymethyl)oxolan-3-ol
SMILESOCC1OC(C2CCCC2)CC1O
InChIInChI=1S/C10H18O3/c11-6-10-8(12)5-9(13-10)7-3-1-2-4-7/h7-12H,1-6H2
InChIKeyQCOGPUZIYNROKM-UHFFFAOYSA-N
XLogP0.69
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopentyl-2-(hydroxymethyl)oxolan-3-ol?
The IUPAC name of 5-cyclopentyl-2-(hydroxymethyl)oxolan-3-ol (CID 167299642) is 5-cyclopentyl-2-(hydroxymethyl)oxolan-3-ol.
What is the SMILES notation for 5-cyclopentyl-2-(hydroxymethyl)oxolan-3-ol?
The canonical SMILES for 5-cyclopentyl-2-(hydroxymethyl)oxolan-3-ol is OCC1OC(C2CCCC2)CC1O.
What is the InChIKey of 5-cyclopentyl-2-(hydroxymethyl)oxolan-3-ol?
The InChIKey is QCOGPUZIYNROKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O3/c11-6-10-8(12)5-9(13-10)7-3-1-2-4-7/h7-12H,1-6H2.
What are the key properties of 5-cyclopentyl-2-(hydroxymethyl)oxolan-3-ol?
5-cyclopentyl-2-(hydroxymethyl)oxolan-3-ol has a molecular weight of 186.25 g/mol, XLogP of 0.69, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopentyl-2-(hydroxymethyl)oxolan-3-ol is sourced from PubChem (CID 167299642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).