1-(3-methyl-1,2-thiazol-5-yl)ethanamine

C6H10N2S — CID 82417947

IUPAC1-(3-methyl-1,2-thiazol-5-yl)ethanamine
SMILESCc1cc(C(C)N)sn1
InChIInChI=1S/C6H10N2S/c1-4-3-6(5(2)7)9-8-4/h3,5H,7H2,1-2H3
InChIKeyJMRGFGINIIQXTD-UHFFFAOYSA-N
MW142.23 g/mol
LogP1.47
Rot. Bonds1

About 1-(3-methyl-1,2-thiazol-5-yl)ethanamine

1-(3-methyl-1,2-thiazol-5-yl)ethanamine (PubChem CID 82417947) has the molecular formula C6H10N2S and a molecular weight of 142.23 g/mol. Its IUPAC name is 1-(3-methyl-1,2-thiazol-5-yl)ethanamine.

Molecular Properties

Compound Name1-(3-methyl-1,2-thiazol-5-yl)ethanamine
PubChem CID82417947
Molecular FormulaC6H10N2S
Molecular Weight142.23 g/mol
Exact Mass142.06
IUPAC Name1-(3-methyl-1,2-thiazol-5-yl)ethanamine
SMILESCc1cc(C(C)N)sn1
InChIInChI=1S/C6H10N2S/c1-4-3-6(5(2)7)9-8-4/h3,5H,7H2,1-2H3
InChIKeyJMRGFGINIIQXTD-UHFFFAOYSA-N
XLogP1.47
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.23
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3-methyl-1,2-thiazol-5-yl)ethanamine 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 1-(3-methyl-1,2-thiazol-5-yl)ethanamine?
The IUPAC name of 1-(3-methyl-1,2-thiazol-5-yl)ethanamine (CID 82417947) is 1-(3-methyl-1,2-thiazol-5-yl)ethanamine.
What is the SMILES notation for 1-(3-methyl-1,2-thiazol-5-yl)ethanamine?
The canonical SMILES for 1-(3-methyl-1,2-thiazol-5-yl)ethanamine is Cc1cc(C(C)N)sn1.
What is the InChIKey of 1-(3-methyl-1,2-thiazol-5-yl)ethanamine?
The InChIKey is JMRGFGINIIQXTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2S/c1-4-3-6(5(2)7)9-8-4/h3,5H,7H2,1-2H3.
What are the key properties of 1-(3-methyl-1,2-thiazol-5-yl)ethanamine?
1-(3-methyl-1,2-thiazol-5-yl)ethanamine has a molecular weight of 142.23 g/mol, XLogP of 1.47, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methyl-1,2-thiazol-5-yl)ethanamine is sourced from PubChem (CID 82417947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).