2-methyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide

C9H20N2O3S — CID 155773090

IUPAC2-methyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide
SMILESCC(C)NS(=O)(=O)CCNC(=O)C(C)C
InChIInChI=1S/C9H20N2O3S/c1-7(2)9(12)10-5-6-15(13,14)11-8(3)4/h7-8,11H,5-6H2,1-4H3,(H,10,12)
InChIKeyDKEPMLPHYLQPTM-UHFFFAOYSA-N
MW236.34 g/mol
LogP0.09
Rot. Bonds6

About 2-methyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide

2-methyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide (PubChem CID 155773090) has the molecular formula C9H20N2O3S and a molecular weight of 236.34 g/mol. Its IUPAC name is 2-methyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide
PubChem CID155773090
Molecular FormulaC9H20N2O3S
Molecular Weight236.34 g/mol
Exact Mass236.12
IUPAC Name2-methyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide
SMILESCC(C)NS(=O)(=O)CCNC(=O)C(C)C
InChIInChI=1S/C9H20N2O3S/c1-7(2)9(12)10-5-6-15(13,14)11-8(3)4/h7-8,11H,5-6H2,1-4H3,(H,10,12)
InChIKeyDKEPMLPHYLQPTM-UHFFFAOYSA-N
XLogP0.09
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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N-ethyl-4-sulfamoylbutanamide
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3-[Dimethyl-[3-(2-methylpropanoylamino)propyl]azaniumyl]propane-1-sulfonate
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2-ethylsulfonyl-N-(3-methylbutan-2-yl)acetamide
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4-(acetylsulfamoyl)-N-ethylbutanamide
CID 138964116
2-fluoro-2-methyl-N-[1-(2-methylpropylsulfonyl)piperidin-4-yl]propanamide
CID 154751979
N-(1-ethylsulfonylpiperidin-4-yl)-2,2-dimethylpropanamide
CID 3218776
(2S)-2-(2,2-dimethylpropanoylamino)-3-methylbutane-1-sulfonic acid
CID 10562712
2-(2,2-Dimethylpropanoylamino)-3-methylbutane-1-sulfonic acid
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CID 9803313

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide?
The IUPAC name of 2-methyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide (CID 155773090) is 2-methyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide.
What is the SMILES notation for 2-methyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide?
The canonical SMILES for 2-methyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide is CC(C)NS(=O)(=O)CCNC(=O)C(C)C.
What is the InChIKey of 2-methyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide?
The InChIKey is DKEPMLPHYLQPTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O3S/c1-7(2)9(12)10-5-6-15(13,14)11-8(3)4/h7-8,11H,5-6H2,1-4H3,(H,10,12).
What are the key properties of 2-methyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide?
2-methyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide has a molecular weight of 236.34 g/mol, XLogP of 0.09, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide is sourced from PubChem (CID 155773090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).