2-[ethenylsulfonyl(ethyl)amino]-N,N-dimethylacetamide

C8H16N2O3S — CID 167818857

IUPAC2-[ethenylsulfonyl(ethyl)amino]-N,N-dimethylacetamide
SMILESC=CS(=O)(=O)N(CC)CC(=O)N(C)C
InChIInChI=1S/C8H16N2O3S/c1-5-10(14(12,13)6-2)7-8(11)9(3)4/h6H,2,5,7H2,1,3-4H3
InChIKeyPDZKNNDVXGUSSI-UHFFFAOYSA-N
MW220.29 g/mol
LogP-0.13
Rot. Bonds5

About 2-[ethenylsulfonyl(ethyl)amino]-N,N-dimethylacetamide

2-[ethenylsulfonyl(ethyl)amino]-N,N-dimethylacetamide (PubChem CID 167818857) has the molecular formula C8H16N2O3S and a molecular weight of 220.29 g/mol. Its IUPAC name is 2-[ethenylsulfonyl(ethyl)amino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[ethenylsulfonyl(ethyl)amino]-N,N-dimethylacetamide
PubChem CID167818857
Molecular FormulaC8H16N2O3S
Molecular Weight220.29 g/mol
Exact Mass220.09
IUPAC Name2-[ethenylsulfonyl(ethyl)amino]-N,N-dimethylacetamide
SMILESC=CS(=O)(=O)N(CC)CC(=O)N(C)C
InChIInChI=1S/C8H16N2O3S/c1-5-10(14(12,13)6-2)7-8(11)9(3)4/h6H,2,5,7H2,1,3-4H3
InChIKeyPDZKNNDVXGUSSI-UHFFFAOYSA-N
XLogP-0.13
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.29
LogP ≤ 5-0.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[ethenylsulfonyl(ethyl)amino]-N,N-dimethylacetamide?
The IUPAC name of 2-[ethenylsulfonyl(ethyl)amino]-N,N-dimethylacetamide (CID 167818857) is 2-[ethenylsulfonyl(ethyl)amino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[ethenylsulfonyl(ethyl)amino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[ethenylsulfonyl(ethyl)amino]-N,N-dimethylacetamide is C=CS(=O)(=O)N(CC)CC(=O)N(C)C.
What is the InChIKey of 2-[ethenylsulfonyl(ethyl)amino]-N,N-dimethylacetamide?
The InChIKey is PDZKNNDVXGUSSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O3S/c1-5-10(14(12,13)6-2)7-8(11)9(3)4/h6H,2,5,7H2,1,3-4H3.
What are the key properties of 2-[ethenylsulfonyl(ethyl)amino]-N,N-dimethylacetamide?
2-[ethenylsulfonyl(ethyl)amino]-N,N-dimethylacetamide has a molecular weight of 220.29 g/mol, XLogP of -0.13, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethenylsulfonyl(ethyl)amino]-N,N-dimethylacetamide is sourced from PubChem (CID 167818857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).