2-methyl-2-(methylamino)-N-(4-methylsulfonylphenyl)propanamide

C12H18N2O3S — CID 55121970

IUPAC2-methyl-2-(methylamino)-N-(4-methylsulfonylphenyl)propanamide
SMILESCNC(C)(C)C(=O)Nc1ccc(S(C)(=O)=O)cc1
InChIInChI=1S/C12H18N2O3S/c1-12(2,13-3)11(15)14-9-5-7-10(8-6-9)18(4,16)17/h5-8,13H,1-4H3,(H,14,15)
InChIKeyNHUGFGHJRGJSRC-UHFFFAOYSA-N
MW270.35 g/mol
LogP1.03
Rot. Bonds4

About 2-methyl-2-(methylamino)-N-(4-methylsulfonylphenyl)propanamide

2-methyl-2-(methylamino)-N-(4-methylsulfonylphenyl)propanamide (PubChem CID 55121970) has the molecular formula C12H18N2O3S and a molecular weight of 270.35 g/mol. Its IUPAC name is 2-methyl-2-(methylamino)-N-(4-methylsulfonylphenyl)propanamide.

Molecular Properties

Compound Name2-methyl-2-(methylamino)-N-(4-methylsulfonylphenyl)propanamide
PubChem CID55121970
Molecular FormulaC12H18N2O3S
Molecular Weight270.35 g/mol
Exact Mass270.10
IUPAC Name2-methyl-2-(methylamino)-N-(4-methylsulfonylphenyl)propanamide
SMILESCNC(C)(C)C(=O)Nc1ccc(S(C)(=O)=O)cc1
InChIInChI=1S/C12H18N2O3S/c1-12(2,13-3)11(15)14-9-5-7-10(8-6-9)18(4,16)17/h5-8,13H,1-4H3,(H,14,15)
InChIKeyNHUGFGHJRGJSRC-UHFFFAOYSA-N
XLogP1.03
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethylamino)-2-methyl-N-(4-methylsulfonylphenyl)propanamide
CID 55121565
2-amino-2-methyl-N-(4-methylsulfonylphenyl)propanamide
CID 61264590
N-(4-acetamidophenyl)-2-methyl-2-(methylamino)propanamide
CID 62835436
2-methyl-2-(methylamino)-N-(4-phenylphenyl)propanamide
CID 62836926
N-[4-(methanesulfonamido)-3-methylphenyl]-2-methyl-2-(methylamino)propanamide
CID 62835077
3-amino-3-methyl-N-(4-methylsulfonylphenyl)butanamide
CID 64683356
1-(2,2-dimethylpropyl)-3-(4-methylsulfonylphenyl)urea
CID 110774671
2-methyl-2-(methylamino)-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 62847063
2,2-dimethyl-N-[4-(methylsulfamoyl)phenyl]butanamide
CID 59806865
1-hydroxy-1-methyl-3-(4-methylsulfonylphenyl)urea
CID 19967425
2-methyl-2-(methylamino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 62845824
2-methyl-2-(methylamino)-N-(6-methylnaphthalen-2-yl)propanamide
CID 115165612

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(methylamino)-N-(4-methylsulfonylphenyl)propanamide?
The IUPAC name of 2-methyl-2-(methylamino)-N-(4-methylsulfonylphenyl)propanamide (CID 55121970) is 2-methyl-2-(methylamino)-N-(4-methylsulfonylphenyl)propanamide.
What is the SMILES notation for 2-methyl-2-(methylamino)-N-(4-methylsulfonylphenyl)propanamide?
The canonical SMILES for 2-methyl-2-(methylamino)-N-(4-methylsulfonylphenyl)propanamide is CNC(C)(C)C(=O)Nc1ccc(S(C)(=O)=O)cc1.
What is the InChIKey of 2-methyl-2-(methylamino)-N-(4-methylsulfonylphenyl)propanamide?
The InChIKey is NHUGFGHJRGJSRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3S/c1-12(2,13-3)11(15)14-9-5-7-10(8-6-9)18(4,16)17/h5-8,13H,1-4H3,(H,14,15).
What are the key properties of 2-methyl-2-(methylamino)-N-(4-methylsulfonylphenyl)propanamide?
2-methyl-2-(methylamino)-N-(4-methylsulfonylphenyl)propanamide has a molecular weight of 270.35 g/mol, XLogP of 1.03, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(methylamino)-N-(4-methylsulfonylphenyl)propanamide is sourced from PubChem (CID 55121970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).