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

C13H20N2O3S — CID 55121565

IUPAC2-(ethylamino)-2-methyl-N-(4-methylsulfonylphenyl)propanamide
SMILESCCNC(C)(C)C(=O)Nc1ccc(S(C)(=O)=O)cc1
InChIInChI=1S/C13H20N2O3S/c1-5-14-13(2,3)12(16)15-10-6-8-11(9-7-10)19(4,17)18/h6-9,14H,5H2,1-4H3,(H,15,16)
InChIKeyNMAINEGJVCDQFZ-UHFFFAOYSA-N
MW284.38 g/mol
LogP1.42
Rot. Bonds5

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

2-(ethylamino)-2-methyl-N-(4-methylsulfonylphenyl)propanamide (PubChem CID 55121565) has the molecular formula C13H20N2O3S and a molecular weight of 284.38 g/mol. Its IUPAC name is 2-(ethylamino)-2-methyl-N-(4-methylsulfonylphenyl)propanamide.

Molecular Properties

Compound Name2-(ethylamino)-2-methyl-N-(4-methylsulfonylphenyl)propanamide
PubChem CID55121565
Molecular FormulaC13H20N2O3S
Molecular Weight284.38 g/mol
Exact Mass284.12
IUPAC Name2-(ethylamino)-2-methyl-N-(4-methylsulfonylphenyl)propanamide
SMILESCCNC(C)(C)C(=O)Nc1ccc(S(C)(=O)=O)cc1
InChIInChI=1S/C13H20N2O3S/c1-5-14-13(2,3)12(16)15-10-6-8-11(9-7-10)19(4,17)18/h6-9,14H,5H2,1-4H3,(H,15,16)
InChIKeyNMAINEGJVCDQFZ-UHFFFAOYSA-N
XLogP1.42
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-2-(methylamino)-N-(4-methylsulfonylphenyl)propanamide
CID 55121970
2-amino-2-methyl-N-(4-methylsulfonylphenyl)propanamide
CID 61264590
2-(ethylamino)-2-methyl-N-[4-(trifluoromethyl)phenyl]propanamide
CID 62833542
N-[4-(cyanomethyl)phenyl]-2-(ethylamino)-2-methylpropanamide
CID 62832358
2-(ethylamino)-2-methyl-N-(3-sulfamoylphenyl)propanamide
CID 55121317
2-(ethylamino)-N-(4-ethyl-3-methylphenyl)-2-methylpropanamide
CID 114250279
4-[[2-(ethylamino)-2-methylpropanoyl]amino]-N-(2-hydroxyethyl)benzamide
CID 62833619
1-(2,2-dimethylpropyl)-3-(4-methylsulfonylphenyl)urea
CID 110774671
3-amino-3-methyl-N-(4-methylsulfonylphenyl)butanamide
CID 64683356
2-methyl-N-(4-methylsulfonylphenyl)butanamide
CID 51331498
2,2-dimethyl-N-[4-(methylsulfamoyl)phenyl]butanamide
CID 59806865
2-(ethylamino)-2-methyl-N-[4-(1,2,4-triazol-1-yl)phenyl]propanamide
CID 62834156

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-2-methyl-N-(4-methylsulfonylphenyl)propanamide?
The IUPAC name of 2-(ethylamino)-2-methyl-N-(4-methylsulfonylphenyl)propanamide (CID 55121565) is 2-(ethylamino)-2-methyl-N-(4-methylsulfonylphenyl)propanamide.
What is the SMILES notation for 2-(ethylamino)-2-methyl-N-(4-methylsulfonylphenyl)propanamide?
The canonical SMILES for 2-(ethylamino)-2-methyl-N-(4-methylsulfonylphenyl)propanamide is CCNC(C)(C)C(=O)Nc1ccc(S(C)(=O)=O)cc1.
What is the InChIKey of 2-(ethylamino)-2-methyl-N-(4-methylsulfonylphenyl)propanamide?
The InChIKey is NMAINEGJVCDQFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3S/c1-5-14-13(2,3)12(16)15-10-6-8-11(9-7-10)19(4,17)18/h6-9,14H,5H2,1-4H3,(H,15,16).
What are the key properties of 2-(ethylamino)-2-methyl-N-(4-methylsulfonylphenyl)propanamide?
2-(ethylamino)-2-methyl-N-(4-methylsulfonylphenyl)propanamide has a molecular weight of 284.38 g/mol, XLogP of 1.42, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-2-methyl-N-(4-methylsulfonylphenyl)propanamide is sourced from PubChem (CID 55121565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).