6-methyl-2,2-dioxo-1,5-dihydroimidazo[4,5-c][1,2,6]thiadiazin-4-amine

C5H7N5O2S — CID 135603538

IUPAC6-methyl-2,2-dioxo-1,5-dihydroimidazo[4,5-c][1,2,6]thiadiazin-4-amine
SMILESCc1nc2c([nH]1)C(N)=NS(=O)(=O)N2
InChIInChI=1S/C5H7N5O2S/c1-2-7-3-4(6)9-13(11,12)10-5(3)8-2/h10H,1H3,(H2,6,9)(H,7,8)
InChIKeyQWQZCSUBSSXYDY-UHFFFAOYSA-N
MW201.21 g/mol
LogP-0.91
Rot. Bonds

About 6-methyl-2,2-dioxo-1,5-dihydroimidazo[4,5-c][1,2,6]thiadiazin-4-amine

6-methyl-2,2-dioxo-1,5-dihydroimidazo[4,5-c][1,2,6]thiadiazin-4-amine (PubChem CID 135603538) has the molecular formula C5H7N5O2S and a molecular weight of 201.21 g/mol. Its IUPAC name is 6-methyl-2,2-dioxo-1,5-dihydroimidazo[4,5-c][1,2,6]thiadiazin-4-amine.

Molecular Properties

Compound Name6-methyl-2,2-dioxo-1,5-dihydroimidazo[4,5-c][1,2,6]thiadiazin-4-amine
PubChem CID135603538
Molecular FormulaC5H7N5O2S
Molecular Weight201.21 g/mol
Exact Mass201.03
IUPAC Name6-methyl-2,2-dioxo-1,5-dihydroimidazo[4,5-c][1,2,6]thiadiazin-4-amine
SMILESCc1nc2c([nH]1)C(N)=NS(=O)(=O)N2
InChIInChI=1S/C5H7N5O2S/c1-2-7-3-4(6)9-13(11,12)10-5(3)8-2/h10H,1H3,(H2,6,9)(H,7,8)
InChIKeyQWQZCSUBSSXYDY-UHFFFAOYSA-N
XLogP-0.91
TPSA113.23 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.21
LogP ≤ 5-0.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2,2-dioxo-1,5-dihydroimidazo[4,5-c][1,2,6]thiadiazin-4-amine?
The IUPAC name of 6-methyl-2,2-dioxo-1,5-dihydroimidazo[4,5-c][1,2,6]thiadiazin-4-amine (CID 135603538) is 6-methyl-2,2-dioxo-1,5-dihydroimidazo[4,5-c][1,2,6]thiadiazin-4-amine.
What is the SMILES notation for 6-methyl-2,2-dioxo-1,5-dihydroimidazo[4,5-c][1,2,6]thiadiazin-4-amine?
The canonical SMILES for 6-methyl-2,2-dioxo-1,5-dihydroimidazo[4,5-c][1,2,6]thiadiazin-4-amine is Cc1nc2c([nH]1)C(N)=NS(=O)(=O)N2.
What is the InChIKey of 6-methyl-2,2-dioxo-1,5-dihydroimidazo[4,5-c][1,2,6]thiadiazin-4-amine?
The InChIKey is QWQZCSUBSSXYDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N5O2S/c1-2-7-3-4(6)9-13(11,12)10-5(3)8-2/h10H,1H3,(H2,6,9)(H,7,8).
What are the key properties of 6-methyl-2,2-dioxo-1,5-dihydroimidazo[4,5-c][1,2,6]thiadiazin-4-amine?
6-methyl-2,2-dioxo-1,5-dihydroimidazo[4,5-c][1,2,6]thiadiazin-4-amine has a molecular weight of 201.21 g/mol, XLogP of -0.91, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2,2-dioxo-1,5-dihydroimidazo[4,5-c][1,2,6]thiadiazin-4-amine is sourced from PubChem (CID 135603538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).