2-(methanesulfonamido)-2-methyl-N-(1-oxopropan-2-yl)propanamide

C8H16N2O4S — CID 22943800

IUPAC2-(methanesulfonamido)-2-methyl-N-(1-oxopropan-2-yl)propanamide
SMILESCC(C=O)NC(=O)C(C)(C)NS(C)(=O)=O
InChIInChI=1S/C8H16N2O4S/c1-6(5-11)9-7(12)8(2,3)10-15(4,13)14/h5-6,10H,1-4H3,(H,9,12)
InChIKeyQHZYIFZKIDDXMA-UHFFFAOYSA-N
MW236.29 g/mol
LogP-0.98
Rot. Bonds5

About 2-(methanesulfonamido)-2-methyl-N-(1-oxopropan-2-yl)propanamide

2-(methanesulfonamido)-2-methyl-N-(1-oxopropan-2-yl)propanamide (PubChem CID 22943800) has the molecular formula C8H16N2O4S and a molecular weight of 236.29 g/mol. Its IUPAC name is 2-(methanesulfonamido)-2-methyl-N-(1-oxopropan-2-yl)propanamide.

Molecular Properties

Compound Name2-(methanesulfonamido)-2-methyl-N-(1-oxopropan-2-yl)propanamide
PubChem CID22943800
Molecular FormulaC8H16N2O4S
Molecular Weight236.29 g/mol
Exact Mass236.08
IUPAC Name2-(methanesulfonamido)-2-methyl-N-(1-oxopropan-2-yl)propanamide
SMILESCC(C=O)NC(=O)C(C)(C)NS(C)(=O)=O
InChIInChI=1S/C8H16N2O4S/c1-6(5-11)9-7(12)8(2,3)10-15(4,13)14/h5-6,10H,1-4H3,(H,9,12)
InChIKeyQHZYIFZKIDDXMA-UHFFFAOYSA-N
XLogP-0.98
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.29
LogP ≤ 5-0.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-(methanesulfonamido)-3-methyl-N-[(2S)-4-methyl-1-oxopentan-2-yl]butanamide
CID 11066263
N-(1-Formyl-3-methyl-butyl)-2-methanesulfonylamino-3-methyl-butyramide
CID 44381886
(2S)-2-(methanesulfonamido)-4-methyl-N-[(2S)-4-methyl-1-oxopentan-2-yl]pentanamide
CID 44367043
2-[[2-(methanesulfonamido)-2-methylpropyl]amino]-N-(2,2,2-trifluoroethyl)propanamide
CID 115619438
N-(1-hydroxypropan-2-yl)-2-(methanesulfonamido)-2-methylpropanamide
CID 20644295
N-[(2S)-butan-2-yl]-2-[methyl(methylsulfonyl)amino]acetamide
CID 30464345
(2R)-2-(methanesulfonamido)-3-methyl-N-(1-oxopropan-2-yl)butanamide
CID 53705619
(2S)-2-(methanesulfonamido)-N-(1-oxopropan-2-yl)propanamide
CID 53738619
2-[2-methylpropyl(methylsulfonyl)amino]-N-propan-2-ylacetamide
CID 59304217
2-[tert-butyl(methylsulfonyl)amino]-N-(3,3-dimethylbutan-2-yl)acetamide
CID 88980578
2-[tert-butyl(methylsulfonyl)amino]-N-[(2S)-3,3-dimethylbutan-2-yl]acetamide
CID 88980588
N-butan-2-yl-2-[2-methylbutan-2-yl(methylsulfonyl)amino]acetamide
CID 89118522

Frequently Asked Questions

What is the IUPAC name of 2-(methanesulfonamido)-2-methyl-N-(1-oxopropan-2-yl)propanamide?
The IUPAC name of 2-(methanesulfonamido)-2-methyl-N-(1-oxopropan-2-yl)propanamide (CID 22943800) is 2-(methanesulfonamido)-2-methyl-N-(1-oxopropan-2-yl)propanamide.
What is the SMILES notation for 2-(methanesulfonamido)-2-methyl-N-(1-oxopropan-2-yl)propanamide?
The canonical SMILES for 2-(methanesulfonamido)-2-methyl-N-(1-oxopropan-2-yl)propanamide is CC(C=O)NC(=O)C(C)(C)NS(C)(=O)=O.
What is the InChIKey of 2-(methanesulfonamido)-2-methyl-N-(1-oxopropan-2-yl)propanamide?
The InChIKey is QHZYIFZKIDDXMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O4S/c1-6(5-11)9-7(12)8(2,3)10-15(4,13)14/h5-6,10H,1-4H3,(H,9,12).
What are the key properties of 2-(methanesulfonamido)-2-methyl-N-(1-oxopropan-2-yl)propanamide?
2-(methanesulfonamido)-2-methyl-N-(1-oxopropan-2-yl)propanamide has a molecular weight of 236.29 g/mol, XLogP of -0.98, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methanesulfonamido)-2-methyl-N-(1-oxopropan-2-yl)propanamide is sourced from PubChem (CID 22943800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).