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

C9H20N2O3S — CID 61383856

IUPAC2-[ethyl(propylsulfonyl)amino]-N,N-dimethylacetamide
SMILESCCCS(=O)(=O)N(CC)CC(=O)N(C)C
InChIInChI=1S/C9H20N2O3S/c1-5-7-15(13,14)11(6-2)8-9(12)10(3)4/h5-8H2,1-4H3
InChIKeyXODRZXVEOWPNNX-UHFFFAOYSA-N
MW236.34 g/mol
LogP0.14
Rot. Bonds6

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

2-[ethyl(propylsulfonyl)amino]-N,N-dimethylacetamide (PubChem CID 61383856) has the molecular formula C9H20N2O3S and a molecular weight of 236.34 g/mol. Its IUPAC name is 2-[ethyl(propylsulfonyl)amino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[ethyl(propylsulfonyl)amino]-N,N-dimethylacetamide
PubChem CID61383856
Molecular FormulaC9H20N2O3S
Molecular Weight236.34 g/mol
Exact Mass236.12
IUPAC Name2-[ethyl(propylsulfonyl)amino]-N,N-dimethylacetamide
SMILESCCCS(=O)(=O)N(CC)CC(=O)N(C)C
InChIInChI=1S/C9H20N2O3S/c1-5-7-15(13,14)11(6-2)8-9(12)10(3)4/h5-8H2,1-4H3
InChIKeyXODRZXVEOWPNNX-UHFFFAOYSA-N
XLogP0.14
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 50.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[2-(dimethylamino)-2-oxoethyl]-ethylsulfamoyl]propanoic acid
CID 43588558
2-[ethyl(propylsulfonyl)amino]acetic acid
CID 61011722
2-[ethenylsulfonyl(ethyl)amino]-N,N-dimethylacetamide
CID 167818857
N-[3-(diethylamino)propyl]-N-ethylpropane-1-sulfonamide
CID 102998334
N-(2-bromoethyl)-N-ethylpropane-1-sulfonamide
CID 80675973
3-[(2-amino-2-oxoethyl)-ethylsulfamoyl]propanoic acid
CID 103101578
ethyl 3-[ethyl-(2-methoxy-2-oxoethyl)sulfamoyl]propanoate
CID 54998323
2-[4-chlorobutylsulfonyl(2-methoxyethyl)amino]-N,N-dimethylacetamide
CID 116815328
2-[bromomethylsulfonyl(2,2,2-trifluoroethyl)amino]-N,N-dimethylacetamide
CID 83084055
2-[[5-(aminomethyl)thiophen-2-yl]sulfonyl-ethylamino]-N,N-dimethylacetamide
CID 106266214
2-[(3-amino-4,5-dimethylphenyl)sulfonyl-ethylamino]-N,N-dimethylacetamide
CID 43587581
2-[3-aminopropylsulfonyl(methyl)amino]-N,N-dimethylacetamide
CID 60910488

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(propylsulfonyl)amino]-N,N-dimethylacetamide?
The IUPAC name of 2-[ethyl(propylsulfonyl)amino]-N,N-dimethylacetamide (CID 61383856) is 2-[ethyl(propylsulfonyl)amino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[ethyl(propylsulfonyl)amino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[ethyl(propylsulfonyl)amino]-N,N-dimethylacetamide is CCCS(=O)(=O)N(CC)CC(=O)N(C)C.
What is the InChIKey of 2-[ethyl(propylsulfonyl)amino]-N,N-dimethylacetamide?
The InChIKey is XODRZXVEOWPNNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O3S/c1-5-7-15(13,14)11(6-2)8-9(12)10(3)4/h5-8H2,1-4H3.
What are the key properties of 2-[ethyl(propylsulfonyl)amino]-N,N-dimethylacetamide?
2-[ethyl(propylsulfonyl)amino]-N,N-dimethylacetamide has a molecular weight of 236.34 g/mol, XLogP of 0.14, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(propylsulfonyl)amino]-N,N-dimethylacetamide is sourced from PubChem (CID 61383856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).