5-methyl-[1,3]thiazolo[5,4-d]pyrimidine

C6H5N3S — CID 592016

IUPAC5-methyl-[1,3]thiazolo[5,4-d]pyrimidine
SMILESCc1ncc2ncsc2n1
InChIInChI=1S/C6H5N3S/c1-4-7-2-5-6(9-4)10-3-8-5/h2-3H,1H3
InChIKeyMMOQXBUGBFDEKS-UHFFFAOYSA-N
MW151.19 g/mol
LogP1.39
Rot. Bonds

About 5-methyl-[1,3]thiazolo[5,4-d]pyrimidine

5-methyl-[1,3]thiazolo[5,4-d]pyrimidine (PubChem CID 592016) has the molecular formula C6H5N3S and a molecular weight of 151.19 g/mol. Its IUPAC name is 5-methyl-[1,3]thiazolo[5,4-d]pyrimidine.

Molecular Properties

Compound Name5-methyl-[1,3]thiazolo[5,4-d]pyrimidine
PubChem CID592016
Molecular FormulaC6H5N3S
Molecular Weight151.19 g/mol
Exact Mass151.02
IUPAC Name5-methyl-[1,3]thiazolo[5,4-d]pyrimidine
SMILESCc1ncc2ncsc2n1
InChIInChI=1S/C6H5N3S/c1-4-7-2-5-6(9-4)10-3-8-5/h2-3H,1H3
InChIKeyMMOQXBUGBFDEKS-UHFFFAOYSA-N
XLogP1.39
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.19
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-methyl-[1,3]thiazolo[5,4-d]pyrimidine 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-methyl-[1,3]thiazolo[5,4-d]pyrimidine?
The IUPAC name of 5-methyl-[1,3]thiazolo[5,4-d]pyrimidine (CID 592016) is 5-methyl-[1,3]thiazolo[5,4-d]pyrimidine.
What is the SMILES notation for 5-methyl-[1,3]thiazolo[5,4-d]pyrimidine?
The canonical SMILES for 5-methyl-[1,3]thiazolo[5,4-d]pyrimidine is Cc1ncc2ncsc2n1.
What is the InChIKey of 5-methyl-[1,3]thiazolo[5,4-d]pyrimidine?
The InChIKey is MMOQXBUGBFDEKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N3S/c1-4-7-2-5-6(9-4)10-3-8-5/h2-3H,1H3.
What are the key properties of 5-methyl-[1,3]thiazolo[5,4-d]pyrimidine?
5-methyl-[1,3]thiazolo[5,4-d]pyrimidine has a molecular weight of 151.19 g/mol, XLogP of 1.39, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-[1,3]thiazolo[5,4-d]pyrimidine is sourced from PubChem (CID 592016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).