2-[2-(3-ethylphenoxy)ethyl]thiophene

C14H16OS — CID 64764928

IUPAC2-[2-(3-ethylphenoxy)ethyl]thiophene
SMILESCCc1cccc(OCCc2cccs2)c1
InChIInChI=1S/C14H16OS/c1-2-12-5-3-6-13(11-12)15-9-8-14-7-4-10-16-14/h3-7,10-11H,2,8-9H2,1H3
InChIKeyYQCMULHPQZDEDJ-UHFFFAOYSA-N
MW232.35 g/mol
LogP3.93
Rot. Bonds5

About 2-[2-(3-ethylphenoxy)ethyl]thiophene

2-[2-(3-ethylphenoxy)ethyl]thiophene (PubChem CID 64764928) has the molecular formula C14H16OS and a molecular weight of 232.35 g/mol. Its IUPAC name is 2-[2-(3-ethylphenoxy)ethyl]thiophene.

Molecular Properties

Compound Name2-[2-(3-ethylphenoxy)ethyl]thiophene
PubChem CID64764928
Molecular FormulaC14H16OS
Molecular Weight232.35 g/mol
Exact Mass232.09
IUPAC Name2-[2-(3-ethylphenoxy)ethyl]thiophene
SMILESCCc1cccc(OCCc2cccs2)c1
InChIInChI=1S/C14H16OS/c1-2-12-5-3-6-13(11-12)15-9-8-14-7-4-10-16-14/h3-7,10-11H,2,8-9H2,1H3
InChIKeyYQCMULHPQZDEDJ-UHFFFAOYSA-N
XLogP3.93
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[3-(2-thiophen-2-ylethoxy)phenyl]methyl]ethanamine
CID 63776029
N-[(3-propoxyphenyl)methyl]-2-thiophen-2-ylethanamine
CID 39374683
3-(2-thiophen-2-ylethoxy)benzaldehyde
CID 63775498
1-ethyl-3-(3-phenoxypropoxy)benzene
CID 64765118
N-[2-(3-methoxyphenoxy)ethyl]-2-thiophen-2-ylethanamine
CID 62572275
1-(2-ethoxyethoxy)-3-ethylbenzene
CID 60642871
ethane;1-ethyl-3-(2-methoxyethoxy)benzene
CID 143725382
4-(2-thiophen-2-ylethoxy)benzene-1,2-diamine
CID 106748443
2-[2-(3-ethylphenoxy)ethyl]aniline
CID 62495247
1-(4-bromobutoxy)-3-ethylbenzene
CID 43165198
1-ethyl-3-(3-methylbutoxy)benzene
CID 64763822
1-(3-ethoxypropoxy)-3-ethylbenzene
CID 65178127

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-ethylphenoxy)ethyl]thiophene?
The IUPAC name of 2-[2-(3-ethylphenoxy)ethyl]thiophene (CID 64764928) is 2-[2-(3-ethylphenoxy)ethyl]thiophene.
What is the SMILES notation for 2-[2-(3-ethylphenoxy)ethyl]thiophene?
The canonical SMILES for 2-[2-(3-ethylphenoxy)ethyl]thiophene is CCc1cccc(OCCc2cccs2)c1.
What is the InChIKey of 2-[2-(3-ethylphenoxy)ethyl]thiophene?
The InChIKey is YQCMULHPQZDEDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16OS/c1-2-12-5-3-6-13(11-12)15-9-8-14-7-4-10-16-14/h3-7,10-11H,2,8-9H2,1H3.
What are the key properties of 2-[2-(3-ethylphenoxy)ethyl]thiophene?
2-[2-(3-ethylphenoxy)ethyl]thiophene has a molecular weight of 232.35 g/mol, XLogP of 3.93, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-ethylphenoxy)ethyl]thiophene is sourced from PubChem (CID 64764928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).