1-[2-(thiophen-3-ylmethoxy)phenyl]ethanamine

C13H15NOS — CID 60880324

IUPAC1-[2-(thiophen-3-ylmethoxy)phenyl]ethanamine
SMILESCC(N)c1ccccc1OCc1ccsc1
InChIInChI=1S/C13H15NOS/c1-10(14)12-4-2-3-5-13(12)15-8-11-6-7-16-9-11/h2-7,9-10H,8,14H2,1H3
InChIKeyGRDPFRYTNGENRV-UHFFFAOYSA-N
MW233.34 g/mol
LogP3.35
Rot. Bonds4

About 1-[2-(thiophen-3-ylmethoxy)phenyl]ethanamine

1-[2-(thiophen-3-ylmethoxy)phenyl]ethanamine (PubChem CID 60880324) has the molecular formula C13H15NOS and a molecular weight of 233.34 g/mol. Its IUPAC name is 1-[2-(thiophen-3-ylmethoxy)phenyl]ethanamine.

Molecular Properties

Compound Name1-[2-(thiophen-3-ylmethoxy)phenyl]ethanamine
PubChem CID60880324
Molecular FormulaC13H15NOS
Molecular Weight233.34 g/mol
Exact Mass233.09
IUPAC Name1-[2-(thiophen-3-ylmethoxy)phenyl]ethanamine
SMILESCC(N)c1ccccc1OCc1ccsc1
InChIInChI=1S/C13H15NOS/c1-10(14)12-4-2-3-5-13(12)15-8-11-6-7-16-9-11/h2-7,9-10H,8,14H2,1H3
InChIKeyGRDPFRYTNGENRV-UHFFFAOYSA-N
XLogP3.35
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-fluoro-2-(thiophen-3-ylmethoxy)phenyl]ethanamine
CID 63066366
(1S)-1-[4-methyl-2-(thiophen-3-ylmethoxy)phenyl]ethanamine
CID 78947153
(1S)-1-(2-phenylmethoxyphenyl)ethanamine;hydrochloride
CID 71758033
(1R)-1-[2-[(4-propan-2-ylphenyl)methoxy]phenyl]ethanamine
CID 28973755
1-[2-[(4-bromophenyl)methoxy]phenyl]ethanamine
CID 60879192
(1S)-1-[2-[(4-bromothiophen-2-yl)methoxy]phenyl]ethanamine
CID 78936454
(1S)-1-[2-[(3-chlorophenyl)methoxy]phenyl]ethanamine
CID 78936371
(1R)-1-[2-[(3-chlorophenyl)methoxy]phenyl]ethanamine
CID 63367090
(1S)-1-[2-[(2-methylphenyl)methoxy]phenyl]ethanamine
CID 30079943
2-(2-phenylmethoxyphenyl)butane-1,3-diamine
CID 57280204
1-[2-(naphthalen-1-ylmethoxy)phenyl]ethanamine
CID 60880695
1-[2-(1,3-benzodioxol-5-ylmethoxy)phenyl]ethanamine
CID 43189048

Frequently Asked Questions

What is the IUPAC name of 1-[2-(thiophen-3-ylmethoxy)phenyl]ethanamine?
The IUPAC name of 1-[2-(thiophen-3-ylmethoxy)phenyl]ethanamine (CID 60880324) is 1-[2-(thiophen-3-ylmethoxy)phenyl]ethanamine.
What is the SMILES notation for 1-[2-(thiophen-3-ylmethoxy)phenyl]ethanamine?
The canonical SMILES for 1-[2-(thiophen-3-ylmethoxy)phenyl]ethanamine is CC(N)c1ccccc1OCc1ccsc1.
What is the InChIKey of 1-[2-(thiophen-3-ylmethoxy)phenyl]ethanamine?
The InChIKey is GRDPFRYTNGENRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NOS/c1-10(14)12-4-2-3-5-13(12)15-8-11-6-7-16-9-11/h2-7,9-10H,8,14H2,1H3.
What are the key properties of 1-[2-(thiophen-3-ylmethoxy)phenyl]ethanamine?
1-[2-(thiophen-3-ylmethoxy)phenyl]ethanamine has a molecular weight of 233.34 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(thiophen-3-ylmethoxy)phenyl]ethanamine is sourced from PubChem (CID 60880324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).