3-(dimethylamino)-N-ethylprop-1-ene-1-sulfonamide

C7H16N2O2S — CID 91486171

IUPAC3-(dimethylamino)-N-ethylprop-1-ene-1-sulfonamide
SMILESCCNS(=O)(=O)C=CCN(C)C
InChIInChI=1S/C7H16N2O2S/c1-4-8-12(10,11)7-5-6-9(2)3/h5,7-8H,4,6H2,1-3H3
InChIKeyHOEYDFTXXKOBGT-UHFFFAOYSA-N
MW192.28 g/mol
LogP0.00
Rot. Bonds5

About 3-(dimethylamino)-N-ethylprop-1-ene-1-sulfonamide

3-(dimethylamino)-N-ethylprop-1-ene-1-sulfonamide (PubChem CID 91486171) has the molecular formula C7H16N2O2S and a molecular weight of 192.28 g/mol. Its IUPAC name is 3-(dimethylamino)-N-ethylprop-1-ene-1-sulfonamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-ethylprop-1-ene-1-sulfonamide
PubChem CID91486171
Molecular FormulaC7H16N2O2S
Molecular Weight192.28 g/mol
Exact Mass192.09
IUPAC Name3-(dimethylamino)-N-ethylprop-1-ene-1-sulfonamide
SMILESCCNS(=O)(=O)C=CCN(C)C
InChIInChI=1S/C7H16N2O2S/c1-4-8-12(10,11)7-5-6-9(2)3/h5,7-8H,4,6H2,1-3H3
InChIKeyHOEYDFTXXKOBGT-UHFFFAOYSA-N
XLogP0.00
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.28
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-ethylprop-1-ene-1-sulfonamide?
The IUPAC name of 3-(dimethylamino)-N-ethylprop-1-ene-1-sulfonamide (CID 91486171) is 3-(dimethylamino)-N-ethylprop-1-ene-1-sulfonamide.
What is the SMILES notation for 3-(dimethylamino)-N-ethylprop-1-ene-1-sulfonamide?
The canonical SMILES for 3-(dimethylamino)-N-ethylprop-1-ene-1-sulfonamide is CCNS(=O)(=O)C=CCN(C)C.
What is the InChIKey of 3-(dimethylamino)-N-ethylprop-1-ene-1-sulfonamide?
The InChIKey is HOEYDFTXXKOBGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2S/c1-4-8-12(10,11)7-5-6-9(2)3/h5,7-8H,4,6H2,1-3H3.
What are the key properties of 3-(dimethylamino)-N-ethylprop-1-ene-1-sulfonamide?
3-(dimethylamino)-N-ethylprop-1-ene-1-sulfonamide has a molecular weight of 192.28 g/mol, XLogP of 0.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-ethylprop-1-ene-1-sulfonamide is sourced from PubChem (CID 91486171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).