2-(1-thiophen-2-ylnonoxy)ethanol

C15H26O2S — CID 173348232

IUPAC2-(1-thiophen-2-ylnonoxy)ethanol
SMILESCCCCCCCCC(OCCO)c1cccs1
InChIInChI=1S/C15H26O2S/c1-2-3-4-5-6-7-9-14(17-12-11-16)15-10-8-13-18-15/h8,10,13-14,16H,2-7,9,11-12H2,1H3
InChIKeyDAFOFFDTEMXRKW-UHFFFAOYSA-N
MW270.44 g/mol
LogP4.55
Rot. Bonds11

About 2-(1-thiophen-2-ylnonoxy)ethanol

2-(1-thiophen-2-ylnonoxy)ethanol (PubChem CID 173348232) has the molecular formula C15H26O2S and a molecular weight of 270.44 g/mol. Its IUPAC name is 2-(1-thiophen-2-ylnonoxy)ethanol.

Molecular Properties

Compound Name2-(1-thiophen-2-ylnonoxy)ethanol
PubChem CID173348232
Molecular FormulaC15H26O2S
Molecular Weight270.44 g/mol
Exact Mass270.17
IUPAC Name2-(1-thiophen-2-ylnonoxy)ethanol
SMILESCCCCCCCCC(OCCO)c1cccs1
InChIInChI=1S/C15H26O2S/c1-2-3-4-5-6-7-9-14(17-12-11-16)15-10-8-13-18-15/h8,10,13-14,16H,2-7,9,11-12H2,1H3
InChIKeyDAFOFFDTEMXRKW-UHFFFAOYSA-N
XLogP4.55
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.44
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[1-(deuteriomethoxy)hexyl]thiophene
CID 162513207
2-tetradecan-7-ylthiophene
CID 137450901
2-heptadecan-5-ylthiophene
CID 19734009
1-thiophen-2-ylundecan-1-amine
CID 63414388
1-thiophen-2-yloctan-1-amine
CID 22115201
2-(1-bromononyl)thiophene
CID 65427153
N-ethyl-1-thiophen-2-ylundecan-1-amine
CID 55186605
2-(3-ethyl-1-phenylnonoxy)ethanol
CID 12997328
methyl 2-thiophen-2-yloctanoate
CID 67745736
2-[1-(furan-2-yl)pentoxy]ethanol
CID 162405799
1-octan-2-yloxy-1-thiophen-2-ylpropan-2-amine
CID 55020955
(1,6-dithiophen-2-yl-6-trimethylsilyloxyhexoxy)-trimethylsilane
CID 11464479

Frequently Asked Questions

What is the IUPAC name of 2-(1-thiophen-2-ylnonoxy)ethanol?
The IUPAC name of 2-(1-thiophen-2-ylnonoxy)ethanol (CID 173348232) is 2-(1-thiophen-2-ylnonoxy)ethanol.
What is the SMILES notation for 2-(1-thiophen-2-ylnonoxy)ethanol?
The canonical SMILES for 2-(1-thiophen-2-ylnonoxy)ethanol is CCCCCCCCC(OCCO)c1cccs1.
What is the InChIKey of 2-(1-thiophen-2-ylnonoxy)ethanol?
The InChIKey is DAFOFFDTEMXRKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O2S/c1-2-3-4-5-6-7-9-14(17-12-11-16)15-10-8-13-18-15/h8,10,13-14,16H,2-7,9,11-12H2,1H3.
What are the key properties of 2-(1-thiophen-2-ylnonoxy)ethanol?
2-(1-thiophen-2-ylnonoxy)ethanol has a molecular weight of 270.44 g/mol, XLogP of 4.55, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-thiophen-2-ylnonoxy)ethanol is sourced from PubChem (CID 173348232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).