N-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine

C11H14N2S2 — CID 63831315

IUPACN-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine
SMILESCC(NCCc1cscn1)c1cccs1
InChIInChI=1S/C11H14N2S2/c1-9(11-3-2-6-15-11)12-5-4-10-7-14-8-13-10/h2-3,6-9,12H,4-5H2,1H3
InChIKeyIAMKUMNETBOYSL-UHFFFAOYSA-N
MW238.38 g/mol
LogP3.10
Rot. Bonds5

About N-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine

N-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine (PubChem CID 63831315) has the molecular formula C11H14N2S2 and a molecular weight of 238.38 g/mol. Its IUPAC name is N-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine.

Molecular Properties

Compound NameN-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine
PubChem CID63831315
Molecular FormulaC11H14N2S2
Molecular Weight238.38 g/mol
Exact Mass238.06
IUPAC NameN-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine
SMILESCC(NCCc1cscn1)c1cccs1
InChIInChI=1S/C11H14N2S2/c1-9(11-3-2-6-15-11)12-5-4-10-7-14-8-13-10/h2-3,6-9,12H,4-5H2,1H3
InChIKeyIAMKUMNETBOYSL-UHFFFAOYSA-N
XLogP3.10
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.38
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1,3-thiazol-4-ylmethyl)-1-thiophen-2-ylethanamine
CID 60696751
1-(4-methyl-1,3-thiazol-5-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]ethanamine
CID 63831687
(1S)-N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]-1-thiophen-2-ylethanamine
CID 81407952
1-(4-methylsulfanylphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]ethanamine
CID 55261999
N-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-3-ylpropan-2-amine
CID 115731927
(1R)-N-[1-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine
CID 104865977
2-(1-thiophen-2-ylethylamino)ethanol
CID 43151185
1-(1-benzofuran-2-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]ethanamine
CID 63831691
1-(2-fluoro-6-methoxyphenyl)-N-[2-(1,3-thiazol-4-yl)ethyl]ethanamine
CID 112700803
4-methyl-N-[(1S)-1-thiophen-2-ylethyl]pentan-1-amine
CID 83156028
3,3-dimethyl-N-[(1S)-1-thiophen-2-ylethyl]butan-1-amine
CID 81398667
3-fluoro-N-[(1R)-1-thiophen-2-ylethyl]propan-1-amine
CID 81408503

Frequently Asked Questions

What is the IUPAC name of N-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine?
The IUPAC name of N-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine (CID 63831315) is N-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine.
What is the SMILES notation for N-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine?
The canonical SMILES for N-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine is CC(NCCc1cscn1)c1cccs1.
What is the InChIKey of N-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine?
The InChIKey is IAMKUMNETBOYSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2S2/c1-9(11-3-2-6-15-11)12-5-4-10-7-14-8-13-10/h2-3,6-9,12H,4-5H2,1H3.
What are the key properties of N-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine?
N-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine has a molecular weight of 238.38 g/mol, XLogP of 3.10, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine is sourced from PubChem (CID 63831315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).