4-ethylimino-7-methyl-1H-pyrazolo[1,5-c][1,3,5]thiadiazin-2-one

C8H10N4OS — CID 135477884

IUPAC4-ethylimino-7-methyl-1H-pyrazolo[1,5-c][1,3,5]thiadiazin-2-one
SMILESCC/N=c1\sc(=O)[nH]c2cc(C)nn12
InChIInChI=1S/C8H10N4OS/c1-3-9-7-12-6(4-5(2)11-12)10-8(13)14-7/h4H,3H2,1-2H3,(H,10,13)/b9-7-
InChIKeyKWFCSTISDGNRBW-CLFYSBASSA-N
MW210.26 g/mol
LogP0.31
Rot. Bonds1

About 4-ethylimino-7-methyl-1H-pyrazolo[1,5-c][1,3,5]thiadiazin-2-one

4-ethylimino-7-methyl-1H-pyrazolo[1,5-c][1,3,5]thiadiazin-2-one (PubChem CID 135477884) has the molecular formula C8H10N4OS and a molecular weight of 210.26 g/mol. Its IUPAC name is 4-ethylimino-7-methyl-1H-pyrazolo[1,5-c][1,3,5]thiadiazin-2-one.

Molecular Properties

Compound Name4-ethylimino-7-methyl-1H-pyrazolo[1,5-c][1,3,5]thiadiazin-2-one
PubChem CID135477884
Molecular FormulaC8H10N4OS
Molecular Weight210.26 g/mol
Exact Mass210.06
IUPAC Name4-ethylimino-7-methyl-1H-pyrazolo[1,5-c][1,3,5]thiadiazin-2-one
SMILESCC/N=c1\sc(=O)[nH]c2cc(C)nn12
InChIInChI=1S/C8H10N4OS/c1-3-9-7-12-6(4-5(2)11-12)10-8(13)14-7/h4H,3H2,1-2H3,(H,10,13)/b9-7-
InChIKeyKWFCSTISDGNRBW-CLFYSBASSA-N
XLogP0.31
TPSA62.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.26
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-ethylimino-7-methyl-1H-pyrazolo[1,5-c][1,3,5]thiadiazin-2-one 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-ethylimino-7-methyl-1H-pyrazolo[1,5-c][1,3,5]thiadiazin-2-one?
The IUPAC name of 4-ethylimino-7-methyl-1H-pyrazolo[1,5-c][1,3,5]thiadiazin-2-one (CID 135477884) is 4-ethylimino-7-methyl-1H-pyrazolo[1,5-c][1,3,5]thiadiazin-2-one.
What is the SMILES notation for 4-ethylimino-7-methyl-1H-pyrazolo[1,5-c][1,3,5]thiadiazin-2-one?
The canonical SMILES for 4-ethylimino-7-methyl-1H-pyrazolo[1,5-c][1,3,5]thiadiazin-2-one is CC/N=c1\sc(=O)[nH]c2cc(C)nn12.
What is the InChIKey of 4-ethylimino-7-methyl-1H-pyrazolo[1,5-c][1,3,5]thiadiazin-2-one?
The InChIKey is KWFCSTISDGNRBW-CLFYSBASSA-N. The full InChI is InChI=1S/C8H10N4OS/c1-3-9-7-12-6(4-5(2)11-12)10-8(13)14-7/h4H,3H2,1-2H3,(H,10,13)/b9-7-.
What are the key properties of 4-ethylimino-7-methyl-1H-pyrazolo[1,5-c][1,3,5]thiadiazin-2-one?
4-ethylimino-7-methyl-1H-pyrazolo[1,5-c][1,3,5]thiadiazin-2-one has a molecular weight of 210.26 g/mol, XLogP of 0.31, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethylimino-7-methyl-1H-pyrazolo[1,5-c][1,3,5]thiadiazin-2-one is sourced from PubChem (CID 135477884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).