2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide

C11H18N4O4S — CID 9489421

IUPAC2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide
SMILESCCNC(=O)CNC(=O)CC1=C(C)NS(=O)(=O)N=C1C
InChIInChI=1S/C11H18N4O4S/c1-4-12-11(17)6-13-10(16)5-9-7(2)14-20(18,19)15-8(9)3/h14H,4-6H2,1-3H3,(H,12,17)(H,13,16)
InChIKeyFDPKXAXNNFLKQT-UHFFFAOYSA-N
MW302.36 g/mol
LogP-0.79
Rot. Bonds5

About 2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide

2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide (PubChem CID 9489421) has the molecular formula C11H18N4O4S and a molecular weight of 302.36 g/mol. Its IUPAC name is 2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide
PubChem CID9489421
Molecular FormulaC11H18N4O4S
Molecular Weight302.36 g/mol
Exact Mass302.10
IUPAC Name2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide
SMILESCCNC(=O)CNC(=O)CC1=C(C)NS(=O)(=O)N=C1C
InChIInChI=1S/C11H18N4O4S/c1-4-12-11(17)6-13-10(16)5-9-7(2)14-20(18,19)15-8(9)3/h14H,4-6H2,1-3H3,(H,12,17)(H,13,16)
InChIKeyFDPKXAXNNFLKQT-UHFFFAOYSA-N
XLogP-0.79
TPSA116.73 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.36
LogP ≤ 5-0.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide with MolForge

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Related Compounds

2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide
CID 9406387
N-[2-(dimethylamino)-2-oxoethyl]-2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)acetamide
CID 9406635
2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide
CID 9406707
N-[2-(dimethylamino)-2-oxoethyl]-2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)acetamide
CID 9513839
2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-oxo-2-(propylamino)ethyl]acetamide
CID 9517300
N-(2-amino-2-oxoethyl)-2-(4,6-dimethyl-2-oxo-1H-pyrimidin-5-yl)acetamide
CID 60693661

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide?
The IUPAC name of 2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide (CID 9489421) is 2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide.
What is the SMILES notation for 2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide?
The canonical SMILES for 2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide is CCNC(=O)CNC(=O)CC1=C(C)NS(=O)(=O)N=C1C.
What is the InChIKey of 2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide?
The InChIKey is FDPKXAXNNFLKQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O4S/c1-4-12-11(17)6-13-10(16)5-9-7(2)14-20(18,19)15-8(9)3/h14H,4-6H2,1-3H3,(H,12,17)(H,13,16).
What are the key properties of 2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide?
2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide has a molecular weight of 302.36 g/mol, XLogP of -0.79, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)-N-[2-(ethylamino)-2-oxoethyl]acetamide is sourced from PubChem (CID 9489421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).