2-(3-phenylpropyl)-2,5-dihydrofuran-3-ol

C13H16O2 — CID 141115159

IUPAC2-(3-phenylpropyl)-2,5-dihydrofuran-3-ol
SMILESOC1=CCOC1CCCc1ccccc1
InChIInChI=1S/C13H16O2/c14-12-9-10-15-13(12)8-4-7-11-5-2-1-3-6-11/h1-3,5-6,9,13-14H,4,7-8,10H2
InChIKeyWVJCHKUXYAXSGQ-UHFFFAOYSA-N
MW204.27 g/mol
LogP2.85
Rot. Bonds4

About 2-(3-phenylpropyl)-2,5-dihydrofuran-3-ol

2-(3-phenylpropyl)-2,5-dihydrofuran-3-ol (PubChem CID 141115159) has the molecular formula C13H16O2 and a molecular weight of 204.27 g/mol. Its IUPAC name is 2-(3-phenylpropyl)-2,5-dihydrofuran-3-ol.

Molecular Properties

Compound Name2-(3-phenylpropyl)-2,5-dihydrofuran-3-ol
PubChem CID141115159
Molecular FormulaC13H16O2
Molecular Weight204.27 g/mol
Exact Mass204.12
IUPAC Name2-(3-phenylpropyl)-2,5-dihydrofuran-3-ol
SMILESOC1=CCOC1CCCc1ccccc1
InChIInChI=1S/C13H16O2/c14-12-9-10-15-13(12)8-4-7-11-5-2-1-3-6-11/h1-3,5-6,9,13-14H,4,7-8,10H2
InChIKeyWVJCHKUXYAXSGQ-UHFFFAOYSA-N
XLogP2.85
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-phenylpropyl)-2,5-dihydrofuran-3-ol?
The IUPAC name of 2-(3-phenylpropyl)-2,5-dihydrofuran-3-ol (CID 141115159) is 2-(3-phenylpropyl)-2,5-dihydrofuran-3-ol.
What is the SMILES notation for 2-(3-phenylpropyl)-2,5-dihydrofuran-3-ol?
The canonical SMILES for 2-(3-phenylpropyl)-2,5-dihydrofuran-3-ol is OC1=CCOC1CCCc1ccccc1.
What is the InChIKey of 2-(3-phenylpropyl)-2,5-dihydrofuran-3-ol?
The InChIKey is WVJCHKUXYAXSGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16O2/c14-12-9-10-15-13(12)8-4-7-11-5-2-1-3-6-11/h1-3,5-6,9,13-14H,4,7-8,10H2.
What are the key properties of 2-(3-phenylpropyl)-2,5-dihydrofuran-3-ol?
2-(3-phenylpropyl)-2,5-dihydrofuran-3-ol has a molecular weight of 204.27 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-phenylpropyl)-2,5-dihydrofuran-3-ol is sourced from PubChem (CID 141115159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).