6-ethyl-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine

C12H12N4S2 — CID 141266147

IUPAC6-ethyl-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine
SMILESCCc1cc2c(N)nc(-c3nc(C)cs3)nc2s1
InChIInChI=1S/C12H12N4S2/c1-3-7-4-8-9(13)15-10(16-11(8)18-7)12-14-6(2)5-17-12/h4-5H,3H2,1-2H3,(H2,13,15,16)
InChIKeyXQETYGCGDUYIGF-UHFFFAOYSA-N
MW276.39 g/mol
LogP3.27
Rot. Bonds2

About 6-ethyl-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine

6-ethyl-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 141266147) has the molecular formula C12H12N4S2 and a molecular weight of 276.39 g/mol. Its IUPAC name is 6-ethyl-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID141266147
Molecular FormulaC12H12N4S2
Molecular Weight276.39 g/mol
Exact Mass276.05
IUPAC Name6-ethyl-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine
SMILESCCc1cc2c(N)nc(-c3nc(C)cs3)nc2s1
InChIInChI=1S/C12H12N4S2/c1-3-7-4-8-9(13)15-10(16-11(8)18-7)12-14-6(2)5-17-12/h4-5H,3H2,1-2H3,(H2,13,15,16)
InChIKeyXQETYGCGDUYIGF-UHFFFAOYSA-N
XLogP3.27
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.39
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-ethyl-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine 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 6-ethyl-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 6-ethyl-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine (CID 141266147) is 6-ethyl-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 6-ethyl-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine is CCc1cc2c(N)nc(-c3nc(C)cs3)nc2s1.
What is the InChIKey of 6-ethyl-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is XQETYGCGDUYIGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4S2/c1-3-7-4-8-9(13)15-10(16-11(8)18-7)12-14-6(2)5-17-12/h4-5H,3H2,1-2H3,(H2,13,15,16).
What are the key properties of 6-ethyl-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine?
6-ethyl-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 276.39 g/mol, XLogP of 3.27, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 141266147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).