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

C14H17NOS — CID 82037470

IUPAC2-[2-(1-thiophen-2-ylethoxy)phenyl]ethanamine
SMILESCC(Oc1ccccc1CCN)c1cccs1
InChIInChI=1S/C14H17NOS/c1-11(14-7-4-10-17-14)16-13-6-3-2-5-12(13)8-9-15/h2-7,10-11H,8-9,15H2,1H3
InChIKeyMBCVLVVLXXUTMG-UHFFFAOYSA-N
MW247.36 g/mol
LogP3.39
Rot. Bonds5

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

2-[2-(1-thiophen-2-ylethoxy)phenyl]ethanamine (PubChem CID 82037470) has the molecular formula C14H17NOS and a molecular weight of 247.36 g/mol. Its IUPAC name is 2-[2-(1-thiophen-2-ylethoxy)phenyl]ethanamine.

Molecular Properties

Compound Name2-[2-(1-thiophen-2-ylethoxy)phenyl]ethanamine
PubChem CID82037470
Molecular FormulaC14H17NOS
Molecular Weight247.36 g/mol
Exact Mass247.10
IUPAC Name2-[2-(1-thiophen-2-ylethoxy)phenyl]ethanamine
SMILESCC(Oc1ccccc1CCN)c1cccs1
InChIInChI=1S/C14H17NOS/c1-11(14-7-4-10-17-14)16-13-6-3-2-5-12(13)8-9-15/h2-7,10-11H,8-9,15H2,1H3
InChIKeyMBCVLVVLXXUTMG-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

2-(2-propan-2-yloxyphenyl)ethanamine
CID 22379502
[3-(1-thiophen-2-ylethoxy)thiophen-2-yl]methanamine
CID 82037333
N-methyl-3-[2-[2-(methylamino)ethyl]phenoxy]-3-thiophen-2-ylpropan-1-amine
CID 138738146
2-(2-methoxyphenyl)ethanamine;hydrochloride
CID 12626553
N-[[2-(difluoromethoxy)phenyl]methyl]-2-methyl-1-thiophen-2-ylpropan-1-amine
CID 43225866
[2-(1-pyridin-4-ylethoxy)phenyl]methanamine
CID 82037250
2-[2-(2-aminoethyl)phenoxy]-1-pyrrolidin-1-ylpropan-1-one
CID 54931415
2-[2-(2-methylpentoxy)phenyl]ethanamine
CID 62266954
[2-[1-(1H-pyrrol-2-yl)ethoxy]phenyl]methanamine
CID 117052101
2-[2-(1-phenylethoxy)phenyl]ethanol
CID 107713134
4-[1-(2-ethylphenoxy)ethyl]aniline
CID 61261291
2-[2-(2-aminoethyl)phenoxy]-N-(3-methylbutan-2-yl)acetamide
CID 61489497

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1-thiophen-2-ylethoxy)phenyl]ethanamine?
The IUPAC name of 2-[2-(1-thiophen-2-ylethoxy)phenyl]ethanamine (CID 82037470) is 2-[2-(1-thiophen-2-ylethoxy)phenyl]ethanamine.
What is the SMILES notation for 2-[2-(1-thiophen-2-ylethoxy)phenyl]ethanamine?
The canonical SMILES for 2-[2-(1-thiophen-2-ylethoxy)phenyl]ethanamine is CC(Oc1ccccc1CCN)c1cccs1.
What is the InChIKey of 2-[2-(1-thiophen-2-ylethoxy)phenyl]ethanamine?
The InChIKey is MBCVLVVLXXUTMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NOS/c1-11(14-7-4-10-17-14)16-13-6-3-2-5-12(13)8-9-15/h2-7,10-11H,8-9,15H2,1H3.
What are the key properties of 2-[2-(1-thiophen-2-ylethoxy)phenyl]ethanamine?
2-[2-(1-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 2-[2-(1-thiophen-2-ylethoxy)phenyl]ethanamine is sourced from PubChem (CID 82037470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).