(2-amino-4-methyl-1,3-thiazol-5-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone

C9H13N3O3S2 — CID 62793907

IUPAC(2-amino-4-methyl-1,3-thiazol-5-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone
SMILESCc1nc(N)sc1C(=O)N1CCS(=O)(=O)CC1
InChIInChI=1S/C9H13N3O3S2/c1-6-7(16-9(10)11-6)8(13)12-2-4-17(14,15)5-3-12/h2-5H2,1H3,(H2,10,11)
InChIKeyOPENXXATFZGLGG-UHFFFAOYSA-N
MW275.35 g/mol
LogP-0.10
Rot. Bonds1

About (2-amino-4-methyl-1,3-thiazol-5-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone

(2-amino-4-methyl-1,3-thiazol-5-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone (PubChem CID 62793907) has the molecular formula C9H13N3O3S2 and a molecular weight of 275.35 g/mol. Its IUPAC name is (2-amino-4-methyl-1,3-thiazol-5-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone.

Molecular Properties

Compound Name(2-amino-4-methyl-1,3-thiazol-5-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone
PubChem CID62793907
Molecular FormulaC9H13N3O3S2
Molecular Weight275.35 g/mol
Exact Mass275.04
IUPAC Name(2-amino-4-methyl-1,3-thiazol-5-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone
SMILESCc1nc(N)sc1C(=O)N1CCS(=O)(=O)CC1
InChIInChI=1S/C9H13N3O3S2/c1-6-7(16-9(10)11-6)8(13)12-2-4-17(14,15)5-3-12/h2-5H2,1H3,(H2,10,11)
InChIKeyOPENXXATFZGLGG-UHFFFAOYSA-N
XLogP-0.10
TPSA93.36 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2-amino-4-methyl-1,3-thiazol-5-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone 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 (2-amino-4-methyl-1,3-thiazol-5-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone?
The IUPAC name of (2-amino-4-methyl-1,3-thiazol-5-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone (CID 62793907) is (2-amino-4-methyl-1,3-thiazol-5-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone.
What is the SMILES notation for (2-amino-4-methyl-1,3-thiazol-5-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone?
The canonical SMILES for (2-amino-4-methyl-1,3-thiazol-5-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone is Cc1nc(N)sc1C(=O)N1CCS(=O)(=O)CC1.
What is the InChIKey of (2-amino-4-methyl-1,3-thiazol-5-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone?
The InChIKey is OPENXXATFZGLGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O3S2/c1-6-7(16-9(10)11-6)8(13)12-2-4-17(14,15)5-3-12/h2-5H2,1H3,(H2,10,11).
What are the key properties of (2-amino-4-methyl-1,3-thiazol-5-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone?
(2-amino-4-methyl-1,3-thiazol-5-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone has a molecular weight of 275.35 g/mol, XLogP of -0.10, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-4-methyl-1,3-thiazol-5-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone is sourced from PubChem (CID 62793907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).