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

C11H14N2S2 — CID 104865977

IUPAC(1R)-N-[1-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine
SMILESCC(N[C@H](C)c1cccs1)c1cscn1
InChIInChI=1S/C11H14N2S2/c1-8(10-6-14-7-12-10)13-9(2)11-4-3-5-15-11/h3-9,13H,1-2H3/t8?,9-/m1/s1
InChIKeySLQMLRJMKUCHDS-YGPZHTELSA-N
MW238.38 g/mol
LogP3.62
Rot. Bonds4

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

(1R)-N-[1-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine (PubChem CID 104865977) has the molecular formula C11H14N2S2 and a molecular weight of 238.38 g/mol. Its IUPAC name is (1R)-N-[1-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine.

Molecular Properties

Compound Name(1R)-N-[1-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine
PubChem CID104865977
Molecular FormulaC11H14N2S2
Molecular Weight238.38 g/mol
Exact Mass238.06
IUPAC Name(1R)-N-[1-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine
SMILESCC(N[C@H](C)c1cccs1)c1cscn1
InChIInChI=1S/C11H14N2S2/c1-8(10-6-14-7-12-10)13-9(2)11-4-3-5-15-11/h3-9,13H,1-2H3/t8?,9-/m1/s1
InChIKeySLQMLRJMKUCHDS-YGPZHTELSA-N
XLogP3.62
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.38
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (1R)-N-[1-(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

3-[1-(1,3-thiazol-4-yl)ethylamino]-3-thiophen-2-ylpropanoic acid
CID 113486874
1-(5-chlorothiophen-2-yl)-N-[1-(1,3-thiazol-4-yl)ethyl]ethanamine
CID 115878972
N-[1-(1,3-thiazol-4-yl)ethyl]propan-2-amine
CID 46784250
N-(1,3-thiazol-4-ylmethyl)-1-thiophen-2-ylethanamine
CID 60696751
1,3-thiazol-4-yl(thiophen-2-yl)methanol
CID 78923935
N-benzhydryl-1-(1,3-thiazol-4-yl)ethanamine
CID 115878793
N-[2-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine
CID 63831315
1-thiophen-3-yl-N-[(1R)-1-thiophen-2-ylethyl]ethanamine
CID 81398257
1-pyridin-4-yl-N-[(1R)-1-thiophen-2-ylethyl]ethanamine
CID 81398579
N-methyl-1-(1,3-thiazol-4-yl)ethanamine
CID 46784246
1-thiophen-2-yl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]ethanamine
CID 106281938
N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1-thiophen-2-ylethanamine
CID 103893462

Frequently Asked Questions

What is the IUPAC name of (1R)-N-[1-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine?
The IUPAC name of (1R)-N-[1-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine (CID 104865977) is (1R)-N-[1-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine.
What is the SMILES notation for (1R)-N-[1-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine?
The canonical SMILES for (1R)-N-[1-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine is CC(N[C@H](C)c1cccs1)c1cscn1.
What is the InChIKey of (1R)-N-[1-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine?
The InChIKey is SLQMLRJMKUCHDS-YGPZHTELSA-N. The full InChI is InChI=1S/C11H14N2S2/c1-8(10-6-14-7-12-10)13-9(2)11-4-3-5-15-11/h3-9,13H,1-2H3/t8?,9-/m1/s1.
What are the key properties of (1R)-N-[1-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine?
(1R)-N-[1-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine has a molecular weight of 238.38 g/mol, XLogP of 3.62, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-[1-(1,3-thiazol-4-yl)ethyl]-1-thiophen-2-ylethanamine is sourced from PubChem (CID 104865977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).