2-[ethyl(methylsulfonyl)amino]-N-propan-2-ylacetamide

C8H18N2O3S — CID 60681329

IUPAC2-[ethyl(methylsulfonyl)amino]-N-propan-2-ylacetamide
SMILESCCN(CC(=O)NC(C)C)S(C)(=O)=O
InChIInChI=1S/C8H18N2O3S/c1-5-10(14(4,12)13)6-8(11)9-7(2)3/h7H,5-6H2,1-4H3,(H,9,11)
InChIKeyIZPLAYOGQNDJGI-UHFFFAOYSA-N
MW222.31 g/mol
LogP-0.21
Rot. Bonds5

About 2-[ethyl(methylsulfonyl)amino]-N-propan-2-ylacetamide

2-[ethyl(methylsulfonyl)amino]-N-propan-2-ylacetamide (PubChem CID 60681329) has the molecular formula C8H18N2O3S and a molecular weight of 222.31 g/mol. Its IUPAC name is 2-[ethyl(methylsulfonyl)amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[ethyl(methylsulfonyl)amino]-N-propan-2-ylacetamide
PubChem CID60681329
Molecular FormulaC8H18N2O3S
Molecular Weight222.31 g/mol
Exact Mass222.10
IUPAC Name2-[ethyl(methylsulfonyl)amino]-N-propan-2-ylacetamide
SMILESCCN(CC(=O)NC(C)C)S(C)(=O)=O
InChIInChI=1S/C8H18N2O3S/c1-5-10(14(4,12)13)6-8(11)9-7(2)3/h7H,5-6H2,1-4H3,(H,9,11)
InChIKeyIZPLAYOGQNDJGI-UHFFFAOYSA-N
XLogP-0.21
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 5-0.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclohexyl(methylsulfonyl)amino]-N-ethylacetamide
CID 1815811
2-[cyclohexyl(methylsulfonyl)amino]-N-propylacetamide
CID 1815812
N-butyl-2-[cyclohexyl(methylsulfonyl)amino]acetamide
CID 1815814
N-(sec-butyl)-2-[cyclohexyl(methylsulfonyl)amino]acetamide
CID 2984150
N~1~-isobutyl-N~2~-methyl-N~2~-(methylsulfonyl)glycinamide
CID 30464341
N-(2-methylpropyl)-2-[[2-(2-methylpropylamino)-2-oxoethyl]-methylsulfonylamino]acetamide
CID 40067441
4-Butylsulfonylpiperazin-2-one
CID 47371379
N-methyl-3-oxo-N-(propan-2-yl)piperazine-1-sulfonamide
CID 53503799
N-[(1-ethylpyrrolidin-2-yl)methyl]-2-[methyl(methylsulfonyl)amino]acetamide
CID 53499006
2-[[2-(methanesulfonamido)-2-methylpropyl]amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 55257321
2-[3-[ethyl(methylsulfonyl)amino]propylamino]-N-(2,2,2-trifluoroethyl)acetamide
CID 61492565
N-[3-[ethyl(methylsulfonyl)amino]propyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 78958505

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(methylsulfonyl)amino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[ethyl(methylsulfonyl)amino]-N-propan-2-ylacetamide (CID 60681329) is 2-[ethyl(methylsulfonyl)amino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[ethyl(methylsulfonyl)amino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[ethyl(methylsulfonyl)amino]-N-propan-2-ylacetamide is CCN(CC(=O)NC(C)C)S(C)(=O)=O.
What is the InChIKey of 2-[ethyl(methylsulfonyl)amino]-N-propan-2-ylacetamide?
The InChIKey is IZPLAYOGQNDJGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O3S/c1-5-10(14(4,12)13)6-8(11)9-7(2)3/h7H,5-6H2,1-4H3,(H,9,11).
What are the key properties of 2-[ethyl(methylsulfonyl)amino]-N-propan-2-ylacetamide?
2-[ethyl(methylsulfonyl)amino]-N-propan-2-ylacetamide has a molecular weight of 222.31 g/mol, XLogP of -0.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(methylsulfonyl)amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 60681329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).