1-(oxolan-2-yl)-3-thiophen-3-ylpropan-1-ol

C11H16O2S — CID 65331589

IUPAC1-(oxolan-2-yl)-3-thiophen-3-ylpropan-1-ol
SMILESOC(CCc1ccsc1)C1CCCO1
InChIInChI=1S/C11H16O2S/c12-10(11-2-1-6-13-11)4-3-9-5-7-14-8-9/h5,7-8,10-12H,1-4,6H2
InChIKeyZTVWVXITJKXQCQ-UHFFFAOYSA-N
MW212.31 g/mol
LogP2.22
Rot. Bonds4

About 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-1-ol

1-(oxolan-2-yl)-3-thiophen-3-ylpropan-1-ol (PubChem CID 65331589) has the molecular formula C11H16O2S and a molecular weight of 212.31 g/mol. Its IUPAC name is 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-1-ol.

Molecular Properties

Compound Name1-(oxolan-2-yl)-3-thiophen-3-ylpropan-1-ol
PubChem CID65331589
Molecular FormulaC11H16O2S
Molecular Weight212.31 g/mol
Exact Mass212.09
IUPAC Name1-(oxolan-2-yl)-3-thiophen-3-ylpropan-1-ol
SMILESOC(CCc1ccsc1)C1CCCO1
InChIInChI=1S/C11H16O2S/c12-10(11-2-1-6-13-11)4-3-9-5-7-14-8-9/h5,7-8,10-12H,1-4,6H2
InChIKeyZTVWVXITJKXQCQ-UHFFFAOYSA-N
XLogP2.22
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.31
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(oxolan-2-yl)-2-thiophen-3-ylethanol
CID 65330907
1-(1,4-dioxan-2-yl)-3-thiophen-3-ylpropan-1-ol
CID 65351236
1-cyclopropyl-3-thiophen-3-ylpropan-1-ol
CID 63354651
4-[3-hydroxy-3-(oxan-2-yl)propyl]phenol
CID 57039358
1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-3-yl)-3-thiophen-3-ylpropan-1-ol
CID 79087408
oxolan-2-yl(thiophen-3-yl)methanol
CID 65331077
1-(oxolan-2-yl)-2-thiophen-3-ylethanamine
CID 61080120
1-(5-methyloxolan-3-yl)-3-thiophen-3-ylpropan-1-ol
CID 115798359
1-(3,4-dihydro-2H-chromen-4-yl)-3-thiophen-3-ylpropan-1-ol
CID 65410166
1-cyclohexyl-5-thiophen-3-ylpentan-3-ol
CID 115798364
1-(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)-3-thiophen-3-ylpropan-1-ol
CID 105097836
1-(1,4-dioxan-2-yl)-3-thiophen-3-ylpropan-1-amine
CID 65351038

Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-1-ol?
The IUPAC name of 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-1-ol (CID 65331589) is 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-1-ol.
What is the SMILES notation for 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-1-ol?
The canonical SMILES for 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-1-ol is OC(CCc1ccsc1)C1CCCO1.
What is the InChIKey of 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-1-ol?
The InChIKey is ZTVWVXITJKXQCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O2S/c12-10(11-2-1-6-13-11)4-3-9-5-7-14-8-9/h5,7-8,10-12H,1-4,6H2.
What are the key properties of 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-1-ol?
1-(oxolan-2-yl)-3-thiophen-3-ylpropan-1-ol has a molecular weight of 212.31 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-2-yl)-3-thiophen-3-ylpropan-1-ol is sourced from PubChem (CID 65331589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).