1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanamine

C14H17NOS — CID 54966969

IUPAC1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanamine
SMILESCC(N)c1ccccc1OCCc1cccs1
InChIInChI=1S/C14H17NOS/c1-11(15)13-6-2-3-7-14(13)16-9-8-12-5-4-10-17-12/h2-7,10-11H,8-9,15H2,1H3
InChIKeyFWDOOTYRBPXSNB-UHFFFAOYSA-N
MW247.36 g/mol
LogP3.39
Rot. Bonds5

About 1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanamine

1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanamine (PubChem CID 54966969) has the molecular formula C14H17NOS and a molecular weight of 247.36 g/mol. Its IUPAC name is 1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanamine.

Molecular Properties

Compound Name1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanamine
PubChem CID54966969
Molecular FormulaC14H17NOS
Molecular Weight247.36 g/mol
Exact Mass247.10
IUPAC Name1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanamine
SMILESCC(N)c1ccccc1OCCc1cccs1
InChIInChI=1S/C14H17NOS/c1-11(15)13-6-2-3-7-14(13)16-9-8-12-5-4-10-17-12/h2-7,10-11H,8-9,15H2,1H3
InChIKeyFWDOOTYRBPXSNB-UHFFFAOYSA-N
XLogP3.39
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.36
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanol
CID 78951125
(1R)-1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine
CID 63370121
1-[5-chloro-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine
CID 63775282
(1S)-1-[4-bromo-2-(2-thiophen-2-ylethoxy)phenyl]ethanamine
CID 102947209
(1R)-1-[1-(2-thiophen-2-ylethoxy)naphthalen-2-yl]ethanamine
CID 78950759
1-(2-propoxyphenyl)-2-thiophen-2-ylethanamine
CID 104660039
1-(2-methylphenyl)-1-(2-thiophen-2-ylethoxy)propan-2-amine
CID 55018719
2-[2-(4-bromo-2-propan-2-ylphenoxy)ethyl]thiophene
CID 113302910
2-[2-(2-fluorophenoxy)ethyl]thiophene
CID 64764713
1-[5-fluoro-2-(2-thiophen-2-ylethoxy)phenyl]propan-2-amine
CID 107700843
1-phenyl-1-(2-thiophen-2-ylethoxy)propan-2-amine
CID 55017191
(1S)-1-[2-(thiophen-2-ylmethoxy)phenyl]propan-1-amine
CID 78932960

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanamine?
The IUPAC name of 1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanamine (CID 54966969) is 1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanamine.
What is the SMILES notation for 1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanamine?
The canonical SMILES for 1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanamine is CC(N)c1ccccc1OCCc1cccs1.
What is the InChIKey of 1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanamine?
The InChIKey is FWDOOTYRBPXSNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NOS/c1-11(15)13-6-2-3-7-14(13)16-9-8-12-5-4-10-17-12/h2-7,10-11H,8-9,15H2,1H3.
What are the key properties of 1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanamine?
1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanamine has a molecular weight of 247.36 g/mol, XLogP of 3.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanamine is sourced from PubChem (CID 54966969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).