5-(oxolan-2-yl)pent-1-en-3-ol

C9H16O2 — CID 115814822

IUPAC5-(oxolan-2-yl)pent-1-en-3-ol
SMILESC=CC(O)CCC1CCCO1
InChIInChI=1S/C9H16O2/c1-2-8(10)5-6-9-4-3-7-11-9/h2,8-10H,1,3-7H2
InChIKeyCZPCIDZHRZIFNG-UHFFFAOYSA-N
MW156.23 g/mol
LogP1.49
Rot. Bonds4

About 5-(oxolan-2-yl)pent-1-en-3-ol

5-(oxolan-2-yl)pent-1-en-3-ol (PubChem CID 115814822) has the molecular formula C9H16O2 and a molecular weight of 156.23 g/mol. Its IUPAC name is 5-(oxolan-2-yl)pent-1-en-3-ol.

Molecular Properties

Compound Name5-(oxolan-2-yl)pent-1-en-3-ol
PubChem CID115814822
Molecular FormulaC9H16O2
Molecular Weight156.23 g/mol
Exact Mass156.12
IUPAC Name5-(oxolan-2-yl)pent-1-en-3-ol
SMILESC=CC(O)CCC1CCCO1
InChIInChI=1S/C9H16O2/c1-2-8(10)5-6-9-4-3-7-11-9/h2,8-10H,1,3-7H2
InChIKeyCZPCIDZHRZIFNG-UHFFFAOYSA-N
XLogP1.49
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-(oxolan-2-yl)heptane-3,4-diol
CID 103454796
4,4-dimethyl-1-(oxolan-2-yl)hexan-3-ol
CID 115809388
1,5-bis(oxolan-2-yl)pentan-3-amine
CID 104993652
(2R)-4-[(2R)-oxan-2-yl]butan-2-ol
CID 11171126
1-cyclopentyl-4-(oxan-2-yl)butan-2-ol
CID 115789825
4-(dimethylamino)-4-methyl-1-(oxolan-2-yl)pentan-3-ol
CID 79047027
4-methyl-1-(oxolan-2-yl)hexan-3-ol
CID 65162291
5,5-dimethyl-1-(oxolan-2-yl)hexane-3,4-diol
CID 103457082
4-ethoxy-4-methyl-1-(oxolan-2-yl)pentan-3-ol
CID 116713726
(2R)-4-[(2R)-oxolan-2-yl]butan-2-amine
CID 7380763
1-(oxolan-2-yl)hept-6-en-3-one
CID 114974959
1-cyclohexyl-3-(oxan-2-yl)propan-1-ol
CID 115802147

Frequently Asked Questions

What is the IUPAC name of 5-(oxolan-2-yl)pent-1-en-3-ol?
The IUPAC name of 5-(oxolan-2-yl)pent-1-en-3-ol (CID 115814822) is 5-(oxolan-2-yl)pent-1-en-3-ol.
What is the SMILES notation for 5-(oxolan-2-yl)pent-1-en-3-ol?
The canonical SMILES for 5-(oxolan-2-yl)pent-1-en-3-ol is C=CC(O)CCC1CCCO1.
What is the InChIKey of 5-(oxolan-2-yl)pent-1-en-3-ol?
The InChIKey is CZPCIDZHRZIFNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2/c1-2-8(10)5-6-9-4-3-7-11-9/h2,8-10H,1,3-7H2.
What are the key properties of 5-(oxolan-2-yl)pent-1-en-3-ol?
5-(oxolan-2-yl)pent-1-en-3-ol has a molecular weight of 156.23 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxolan-2-yl)pent-1-en-3-ol is sourced from PubChem (CID 115814822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).