6-ethyl-1-thiophen-2-yloctan-4-ol

C14H24OS — CID 105122585

IUPAC6-ethyl-1-thiophen-2-yloctan-4-ol
SMILESCCC(CC)CC(O)CCCc1cccs1
InChIInChI=1S/C14H24OS/c1-3-12(4-2)11-13(15)7-5-8-14-9-6-10-16-14/h6,9-10,12-13,15H,3-5,7-8,11H2,1-2H3
InChIKeyUBLMSYBIEIHLSC-UHFFFAOYSA-N
MW240.41 g/mol
LogP4.26
Rot. Bonds8

About 6-ethyl-1-thiophen-2-yloctan-4-ol

6-ethyl-1-thiophen-2-yloctan-4-ol (PubChem CID 105122585) has the molecular formula C14H24OS and a molecular weight of 240.41 g/mol. Its IUPAC name is 6-ethyl-1-thiophen-2-yloctan-4-ol.

Molecular Properties

Compound Name6-ethyl-1-thiophen-2-yloctan-4-ol
PubChem CID105122585
Molecular FormulaC14H24OS
Molecular Weight240.41 g/mol
Exact Mass240.15
IUPAC Name6-ethyl-1-thiophen-2-yloctan-4-ol
SMILESCCC(CC)CC(O)CCCc1cccs1
InChIInChI=1S/C14H24OS/c1-3-12(4-2)11-13(15)7-5-8-14-9-6-10-16-14/h6,9-10,12-13,15H,3-5,7-8,11H2,1-2H3
InChIKeyUBLMSYBIEIHLSC-UHFFFAOYSA-N
XLogP4.26
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.41
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-thiophen-2-yloctan-4-ol
CID 64516293
1-amino-5-thiophen-2-ylpentan-2-ol
CID 54294228
5-methyl-1-thiophen-2-ylheptan-3-ol
CID 115800369
2-methyl-6-thiophen-2-ylhexan-3-ol
CID 63774630
1-thiophen-2-yloct-7-yn-4-ol
CID 105098636
7-thiophen-2-ylhept-1-en-4-ol
CID 105081719
1-(furan-3-yl)-5-thiophen-2-ylpentan-2-ol
CID 105123144
1-pyridin-4-yl-5-thiophen-2-ylpentan-2-ol
CID 66460697
1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpentan-2-ol
CID 105089080
2-ethyl-4-thiophen-2-ylbutan-1-amine
CID 63774088
2-[3-(bromomethyl)pentyl]thiophene
CID 66043053
4-ethyl-1-thiophen-2-ylhexan-3-ol
CID 65148531

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-1-thiophen-2-yloctan-4-ol?
The IUPAC name of 6-ethyl-1-thiophen-2-yloctan-4-ol (CID 105122585) is 6-ethyl-1-thiophen-2-yloctan-4-ol.
What is the SMILES notation for 6-ethyl-1-thiophen-2-yloctan-4-ol?
The canonical SMILES for 6-ethyl-1-thiophen-2-yloctan-4-ol is CCC(CC)CC(O)CCCc1cccs1.
What is the InChIKey of 6-ethyl-1-thiophen-2-yloctan-4-ol?
The InChIKey is UBLMSYBIEIHLSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24OS/c1-3-12(4-2)11-13(15)7-5-8-14-9-6-10-16-14/h6,9-10,12-13,15H,3-5,7-8,11H2,1-2H3.
What are the key properties of 6-ethyl-1-thiophen-2-yloctan-4-ol?
6-ethyl-1-thiophen-2-yloctan-4-ol has a molecular weight of 240.41 g/mol, XLogP of 4.26, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-1-thiophen-2-yloctan-4-ol is sourced from PubChem (CID 105122585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).