2-(thiophen-2-ylmethyl)decan-1-ol

C15H26OS — CID 162415958

IUPAC2-(thiophen-2-ylmethyl)decan-1-ol
SMILESCCCCCCCCC(CO)Cc1cccs1
InChIInChI=1S/C15H26OS/c1-2-3-4-5-6-7-9-14(13-16)12-15-10-8-11-17-15/h8,10-11,14,16H,2-7,9,12-13H2,1H3
InChIKeyJGTWLEYEGBXUAC-UHFFFAOYSA-N
MW254.44 g/mol
LogP4.65
Rot. Bonds10

About 2-(thiophen-2-ylmethyl)decan-1-ol

2-(thiophen-2-ylmethyl)decan-1-ol (PubChem CID 162415958) has the molecular formula C15H26OS and a molecular weight of 254.44 g/mol. Its IUPAC name is 2-(thiophen-2-ylmethyl)decan-1-ol.

Molecular Properties

Compound Name2-(thiophen-2-ylmethyl)decan-1-ol
PubChem CID162415958
Molecular FormulaC15H26OS
Molecular Weight254.44 g/mol
Exact Mass254.17
IUPAC Name2-(thiophen-2-ylmethyl)decan-1-ol
SMILESCCCCCCCCC(CO)Cc1cccs1
InChIInChI=1S/C15H26OS/c1-2-3-4-5-6-7-9-14(13-16)12-15-10-8-11-17-15/h8,10-11,14,16H,2-7,9,12-13H2,1H3
InChIKeyJGTWLEYEGBXUAC-UHFFFAOYSA-N
XLogP4.65
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.44
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(Thiophen-2-yl)propan-1-ol
CID 13109866
2-(5-Methylthiophen-2-yl)ethan-1-ol
CID 13289289
2-(2-Thienyl)cyclohexanol
CID 2760612
2-(2,5-Dimethylthiophen-3-yl)ethan-1-ol
CID 13144702
3-Hydroxy-2-(thiophen-2-ylmethyl)propanenitrile
CID 55163473
rac-[(1R,2R)-2-(thiophen-2-yl)cyclopropyl]methanol
CID 67942345
4-(Thiophen-2-yl)butan-1-ol
CID 12623862
[(1R,2R)-2-(5-Bromothiophen-2-yl)cyclopropyl]methanol
CID 155821129
Tiagabine alcohol
CID 49765331
(2R)-2-fluoro-3-thiophen-2-ylpropan-1-ol
CID 155930775
3-Methyl-5-(2-thienyl)pentanol
CID 23272364
2-(4-Phenylthiophen-2-yl)ethanol
CID 125484470

Frequently Asked Questions

What is the IUPAC name of 2-(thiophen-2-ylmethyl)decan-1-ol?
The IUPAC name of 2-(thiophen-2-ylmethyl)decan-1-ol (CID 162415958) is 2-(thiophen-2-ylmethyl)decan-1-ol.
What is the SMILES notation for 2-(thiophen-2-ylmethyl)decan-1-ol?
The canonical SMILES for 2-(thiophen-2-ylmethyl)decan-1-ol is CCCCCCCCC(CO)Cc1cccs1.
What is the InChIKey of 2-(thiophen-2-ylmethyl)decan-1-ol?
The InChIKey is JGTWLEYEGBXUAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26OS/c1-2-3-4-5-6-7-9-14(13-16)12-15-10-8-11-17-15/h8,10-11,14,16H,2-7,9,12-13H2,1H3.
What are the key properties of 2-(thiophen-2-ylmethyl)decan-1-ol?
2-(thiophen-2-ylmethyl)decan-1-ol has a molecular weight of 254.44 g/mol, XLogP of 4.65, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(thiophen-2-ylmethyl)decan-1-ol is sourced from PubChem (CID 162415958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).