5-ethyl-4-thiophen-2-yl-1,3-thiazol-2-amine;hydrochloride

C9H11ClN2S2 — CID 46736490

IUPAC5-ethyl-4-thiophen-2-yl-1,3-thiazol-2-amine;hydrochloride
SMILESCCc1sc(N)nc1-c1cccs1.Cl
InChIInChI=1S/C9H10N2S2.ClH/c1-2-6-8(11-9(10)13-6)7-4-3-5-12-7;/h3-5H,2H2,1H3,(H2,10,11);1H
InChIKeyQSTGMIJSGMAKQR-UHFFFAOYSA-N
MW246.79 g/mol
LogP3.44
Rot. Bonds2

About 5-ethyl-4-thiophen-2-yl-1,3-thiazol-2-amine;hydrochloride

5-ethyl-4-thiophen-2-yl-1,3-thiazol-2-amine;hydrochloride (PubChem CID 46736490) has the molecular formula C9H11ClN2S2 and a molecular weight of 246.79 g/mol. Its IUPAC name is 5-ethyl-4-thiophen-2-yl-1,3-thiazol-2-amine;hydrochloride.

Molecular Properties

Compound Name5-ethyl-4-thiophen-2-yl-1,3-thiazol-2-amine;hydrochloride
PubChem CID46736490
Molecular FormulaC9H11ClN2S2
Molecular Weight246.79 g/mol
Exact Mass246.01
IUPAC Name5-ethyl-4-thiophen-2-yl-1,3-thiazol-2-amine;hydrochloride
SMILESCCc1sc(N)nc1-c1cccs1.Cl
InChIInChI=1S/C9H10N2S2.ClH/c1-2-6-8(11-9(10)13-6)7-4-3-5-12-7;/h3-5H,2H2,1H3,(H2,10,11);1H
InChIKeyQSTGMIJSGMAKQR-UHFFFAOYSA-N
XLogP3.44
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.79
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-ethyl-4-thiophen-2-yl-1,3-thiazol-2-amine;hydrochloride with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-thiophen-2-yl-1,3-thiazol-2-amine;hydrochloride?
The IUPAC name of 5-ethyl-4-thiophen-2-yl-1,3-thiazol-2-amine;hydrochloride (CID 46736490) is 5-ethyl-4-thiophen-2-yl-1,3-thiazol-2-amine;hydrochloride.
What is the SMILES notation for 5-ethyl-4-thiophen-2-yl-1,3-thiazol-2-amine;hydrochloride?
The canonical SMILES for 5-ethyl-4-thiophen-2-yl-1,3-thiazol-2-amine;hydrochloride is CCc1sc(N)nc1-c1cccs1.Cl.
What is the InChIKey of 5-ethyl-4-thiophen-2-yl-1,3-thiazol-2-amine;hydrochloride?
The InChIKey is QSTGMIJSGMAKQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2S2.ClH/c1-2-6-8(11-9(10)13-6)7-4-3-5-12-7;/h3-5H,2H2,1H3,(H2,10,11);1H.
What are the key properties of 5-ethyl-4-thiophen-2-yl-1,3-thiazol-2-amine;hydrochloride?
5-ethyl-4-thiophen-2-yl-1,3-thiazol-2-amine;hydrochloride has a molecular weight of 246.79 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-thiophen-2-yl-1,3-thiazol-2-amine;hydrochloride is sourced from PubChem (CID 46736490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).