1-[2-(dimethylamino)ethyl]-6,7-dimethyl-2,2-dioxopyrazino[2,3-c][1,2,6]thiadiazin-4-amine

C11H18N6O2S — CID 10469978

IUPAC1-[2-(dimethylamino)ethyl]-6,7-dimethyl-2,2-dioxopyrazino[2,3-c][1,2,6]thiadiazin-4-amine
SMILESCc1nc2c(nc1C)N(CCN(C)C)S(=O)(=O)N=C2N
InChIInChI=1S/C11H18N6O2S/c1-7-8(2)14-11-9(13-7)10(12)15-20(18,19)17(11)6-5-16(3)4/h5-6H2,1-4H3,(H2,12,15)
InChIKeySADWNTQDRFOWQJ-UHFFFAOYSA-N
MW298.37 g/mol
LogP-0.57
Rot. Bonds3

About 1-[2-(dimethylamino)ethyl]-6,7-dimethyl-2,2-dioxopyrazino[2,3-c][1,2,6]thiadiazin-4-amine

1-[2-(dimethylamino)ethyl]-6,7-dimethyl-2,2-dioxopyrazino[2,3-c][1,2,6]thiadiazin-4-amine (PubChem CID 10469978) has the molecular formula C11H18N6O2S and a molecular weight of 298.37 g/mol. Its IUPAC name is 1-[2-(dimethylamino)ethyl]-6,7-dimethyl-2,2-dioxopyrazino[2,3-c][1,2,6]thiadiazin-4-amine.

Molecular Properties

Compound Name1-[2-(dimethylamino)ethyl]-6,7-dimethyl-2,2-dioxopyrazino[2,3-c][1,2,6]thiadiazin-4-amine
PubChem CID10469978
Molecular FormulaC11H18N6O2S
Molecular Weight298.37 g/mol
Exact Mass298.12
IUPAC Name1-[2-(dimethylamino)ethyl]-6,7-dimethyl-2,2-dioxopyrazino[2,3-c][1,2,6]thiadiazin-4-amine
SMILESCc1nc2c(nc1C)N(CCN(C)C)S(=O)(=O)N=C2N
InChIInChI=1S/C11H18N6O2S/c1-7-8(2)14-11-9(13-7)10(12)15-20(18,19)17(11)6-5-16(3)4/h5-6H2,1-4H3,(H2,12,15)
InChIKeySADWNTQDRFOWQJ-UHFFFAOYSA-N
XLogP-0.57
TPSA104.78 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.37
LogP ≤ 5-0.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-[2-(dimethylamino)ethyl]-6,7-dimethyl-2,2-dioxopyrazino[2,3-c][1,2,6]thiadiazin-4-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 1-[2-(dimethylamino)ethyl]-6,7-dimethyl-2,2-dioxopyrazino[2,3-c][1,2,6]thiadiazin-4-amine?
The IUPAC name of 1-[2-(dimethylamino)ethyl]-6,7-dimethyl-2,2-dioxopyrazino[2,3-c][1,2,6]thiadiazin-4-amine (CID 10469978) is 1-[2-(dimethylamino)ethyl]-6,7-dimethyl-2,2-dioxopyrazino[2,3-c][1,2,6]thiadiazin-4-amine.
What is the SMILES notation for 1-[2-(dimethylamino)ethyl]-6,7-dimethyl-2,2-dioxopyrazino[2,3-c][1,2,6]thiadiazin-4-amine?
The canonical SMILES for 1-[2-(dimethylamino)ethyl]-6,7-dimethyl-2,2-dioxopyrazino[2,3-c][1,2,6]thiadiazin-4-amine is Cc1nc2c(nc1C)N(CCN(C)C)S(=O)(=O)N=C2N.
What is the InChIKey of 1-[2-(dimethylamino)ethyl]-6,7-dimethyl-2,2-dioxopyrazino[2,3-c][1,2,6]thiadiazin-4-amine?
The InChIKey is SADWNTQDRFOWQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N6O2S/c1-7-8(2)14-11-9(13-7)10(12)15-20(18,19)17(11)6-5-16(3)4/h5-6H2,1-4H3,(H2,12,15).
What are the key properties of 1-[2-(dimethylamino)ethyl]-6,7-dimethyl-2,2-dioxopyrazino[2,3-c][1,2,6]thiadiazin-4-amine?
1-[2-(dimethylamino)ethyl]-6,7-dimethyl-2,2-dioxopyrazino[2,3-c][1,2,6]thiadiazin-4-amine has a molecular weight of 298.37 g/mol, XLogP of -0.57, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)ethyl]-6,7-dimethyl-2,2-dioxopyrazino[2,3-c][1,2,6]thiadiazin-4-amine is sourced from PubChem (CID 10469978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).