2-(2-methoxyethoxy)ethyl thiophene-2-carboxylate

C10H14O4S — CID 174814348

IUPAC2-(2-methoxyethoxy)ethyl thiophene-2-carboxylate
SMILESCOCCOCCOC(=O)c1cccs1
InChIInChI=1S/C10H14O4S/c1-12-4-5-13-6-7-14-10(11)9-3-2-8-15-9/h2-3,8H,4-7H2,1H3
InChIKeyUCIKVXLCNAQBHB-UHFFFAOYSA-N
MW230.28 g/mol
LogP1.57
Rot. Bonds7

About 2-(2-methoxyethoxy)ethyl thiophene-2-carboxylate

2-(2-methoxyethoxy)ethyl thiophene-2-carboxylate (PubChem CID 174814348) has the molecular formula C10H14O4S and a molecular weight of 230.28 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)ethyl thiophene-2-carboxylate.

Molecular Properties

Compound Name2-(2-methoxyethoxy)ethyl thiophene-2-carboxylate
PubChem CID174814348
Molecular FormulaC10H14O4S
Molecular Weight230.28 g/mol
Exact Mass230.06
IUPAC Name2-(2-methoxyethoxy)ethyl thiophene-2-carboxylate
SMILESCOCCOCCOC(=O)c1cccs1
InChIInChI=1S/C10H14O4S/c1-12-4-5-13-6-7-14-10(11)9-3-2-8-15-9/h2-3,8H,4-7H2,1H3
InChIKeyUCIKVXLCNAQBHB-UHFFFAOYSA-N
XLogP1.57
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.28
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1-thiophen-2-ylbutan-1-one
CID 104563857
2-sulfanylethyl thiophene-2-carboxylate
CID 175040305
3-(thiophene-2-carbonyloxy)propanoic acid
CID 138555972
heptyl thiophene-2-carboxylate
CID 574115
2-(dimethylamino)ethyl thiophene-2-carboxylate;hydrochloride
CID 52998113
aminomethyl thiophene-2-carboxylate
CID 142796710
4-(2-methylprop-2-enoyloxy)butyl thiophene-2-carboxylate
CID 21182205
N-[(2S)-1-methoxypropan-2-yl]thiophene-2-carboxamide
CID 670280
2-amino-4-methoxy-1-thiophen-2-ylbutan-1-one
CID 116567437
3-(dibutylamino)propyl thiophene-2-carboxylate;hydrochloride
CID 3032008
4-cyanobutyl thiophene-2-carboxylate
CID 132538634
N-[2-[2-(2-methoxyethoxy)ethylamino]-2-oxoethyl]-N-methylthiophene-2-carboxamide
CID 86985377

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethoxy)ethyl thiophene-2-carboxylate?
The IUPAC name of 2-(2-methoxyethoxy)ethyl thiophene-2-carboxylate (CID 174814348) is 2-(2-methoxyethoxy)ethyl thiophene-2-carboxylate.
What is the SMILES notation for 2-(2-methoxyethoxy)ethyl thiophene-2-carboxylate?
The canonical SMILES for 2-(2-methoxyethoxy)ethyl thiophene-2-carboxylate is COCCOCCOC(=O)c1cccs1.
What is the InChIKey of 2-(2-methoxyethoxy)ethyl thiophene-2-carboxylate?
The InChIKey is UCIKVXLCNAQBHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O4S/c1-12-4-5-13-6-7-14-10(11)9-3-2-8-15-9/h2-3,8H,4-7H2,1H3.
What are the key properties of 2-(2-methoxyethoxy)ethyl thiophene-2-carboxylate?
2-(2-methoxyethoxy)ethyl thiophene-2-carboxylate has a molecular weight of 230.28 g/mol, XLogP of 1.57, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)ethyl thiophene-2-carboxylate is sourced from PubChem (CID 174814348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).