3-(1-hydroxycyclopentyl)oxolan-2-one

C9H14O3 — CID 12664726

IUPAC3-(1-hydroxycyclopentyl)oxolan-2-one
SMILESO=C1OCCC1C1(O)CCCC1
InChIInChI=1S/C9H14O3/c10-8-7(3-6-12-8)9(11)4-1-2-5-9/h7,11H,1-6H2
InChIKeyOMDIVYIZSTWUBK-UHFFFAOYSA-N
MW170.21 g/mol
LogP0.85
Rot. Bonds1

About 3-(1-hydroxycyclopentyl)oxolan-2-one

3-(1-hydroxycyclopentyl)oxolan-2-one (PubChem CID 12664726) has the molecular formula C9H14O3 and a molecular weight of 170.21 g/mol. Its IUPAC name is 3-(1-hydroxycyclopentyl)oxolan-2-one.

Molecular Properties

Compound Name3-(1-hydroxycyclopentyl)oxolan-2-one
PubChem CID12664726
Molecular FormulaC9H14O3
Molecular Weight170.21 g/mol
Exact Mass170.09
IUPAC Name3-(1-hydroxycyclopentyl)oxolan-2-one
SMILESO=C1OCCC1C1(O)CCCC1
InChIInChI=1S/C9H14O3/c10-8-7(3-6-12-8)9(11)4-1-2-5-9/h7,11H,1-6H2
InChIKeyOMDIVYIZSTWUBK-UHFFFAOYSA-N
XLogP0.85
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4a-hydroxy-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one
CID 91357304
8a-hydroxy-1,2,3,3a,5,6,7,8-octahydroazulen-4-one
CID 10773424
5-hydroxy-5-methyl-3,4,4a,6,7,7a-hexahydrocyclopenta[c]pyran-1-one
CID 22168792
4-(1-hydroxycyclohexyl)oxolan-2-one
CID 12664730
(3R)-3-hydroxyoxan-2-one
CID 10313119
[2-(2-oxooxolan-3-yl)-2-bicyclo[2.2.1]heptanyl] prop-2-enoate
CID 59392253
CID 90143310
CID 90143310
3-(bromoamino)oxolan-2-one
CID 59414203
2-methyl-2-[(2-oxooxolan-3-yl)amino]propanal
CID 144540699
(1R,8R,13S,20R)-3,6,15,18-tetraoxatricyclo[18.4.0.08,13]tetracosane-2,7,14,19-tetrone
CID 7052269
(3aR,6aR)-3a-hydroxy-4,5,6,6a-tetrahydro-3H-cyclopenta[b]furan-2-one
CID 10630599
(3R,4S)-4-hydroxy-3-methyloxan-2-one
CID 10654248

Frequently Asked Questions

What is the IUPAC name of 3-(1-hydroxycyclopentyl)oxolan-2-one?
The IUPAC name of 3-(1-hydroxycyclopentyl)oxolan-2-one (CID 12664726) is 3-(1-hydroxycyclopentyl)oxolan-2-one.
What is the SMILES notation for 3-(1-hydroxycyclopentyl)oxolan-2-one?
The canonical SMILES for 3-(1-hydroxycyclopentyl)oxolan-2-one is O=C1OCCC1C1(O)CCCC1.
What is the InChIKey of 3-(1-hydroxycyclopentyl)oxolan-2-one?
The InChIKey is OMDIVYIZSTWUBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14O3/c10-8-7(3-6-12-8)9(11)4-1-2-5-9/h7,11H,1-6H2.
What are the key properties of 3-(1-hydroxycyclopentyl)oxolan-2-one?
3-(1-hydroxycyclopentyl)oxolan-2-one has a molecular weight of 170.21 g/mol, XLogP of 0.85, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-hydroxycyclopentyl)oxolan-2-one is sourced from PubChem (CID 12664726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).