4-oxo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]thiazin-3-amine

C6H9N3OS — CID 171501257

IUPAC4-oxo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]thiazin-3-amine
SMILESNc1cnn2c1S(=O)CCC2
InChIInChI=1S/C6H9N3OS/c7-5-4-8-9-2-1-3-11(10)6(5)9/h4H,1-3,7H2
InChIKeyUUIWVEGBHLCAFX-UHFFFAOYSA-N
MW171.22 g/mol
LogP-0.02
Rot. Bonds

About 4-oxo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]thiazin-3-amine

4-oxo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]thiazin-3-amine (PubChem CID 171501257) has the molecular formula C6H9N3OS and a molecular weight of 171.22 g/mol. Its IUPAC name is 4-oxo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]thiazin-3-amine.

Molecular Properties

Compound Name4-oxo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]thiazin-3-amine
PubChem CID171501257
Molecular FormulaC6H9N3OS
Molecular Weight171.22 g/mol
Exact Mass171.05
IUPAC Name4-oxo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]thiazin-3-amine
SMILESNc1cnn2c1S(=O)CCC2
InChIInChI=1S/C6H9N3OS/c7-5-4-8-9-2-1-3-11(10)6(5)9/h4H,1-3,7H2
InChIKeyUUIWVEGBHLCAFX-UHFFFAOYSA-N
XLogP-0.02
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.22
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-oxo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]thiazin-3-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 4-oxo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]thiazin-3-amine?
The IUPAC name of 4-oxo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]thiazin-3-amine (CID 171501257) is 4-oxo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]thiazin-3-amine.
What is the SMILES notation for 4-oxo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]thiazin-3-amine?
The canonical SMILES for 4-oxo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]thiazin-3-amine is Nc1cnn2c1S(=O)CCC2.
What is the InChIKey of 4-oxo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]thiazin-3-amine?
The InChIKey is UUIWVEGBHLCAFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3OS/c7-5-4-8-9-2-1-3-11(10)6(5)9/h4H,1-3,7H2.
What are the key properties of 4-oxo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]thiazin-3-amine?
4-oxo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]thiazin-3-amine has a molecular weight of 171.22 g/mol, XLogP of -0.02, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-oxo-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]thiazin-3-amine is sourced from PubChem (CID 171501257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).