2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide

C13H20N2O3S — CID 55103402

IUPAC2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide
SMILESCCC(C)(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1C
InChIInChI=1S/C13H20N2O3S/c1-5-13(3,4)12(16)15-11-8-10(19(14,17)18)7-6-9(11)2/h6-8H,5H2,1-4H3,(H,15,16)(H2,14,17,18)
InChIKeyFVBDXUSSYZJOHI-UHFFFAOYSA-N
MW284.38 g/mol
LogP2.02
Rot. Bonds4

About 2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide

2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide (PubChem CID 55103402) has the molecular formula C13H20N2O3S and a molecular weight of 284.38 g/mol. Its IUPAC name is 2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide
PubChem CID55103402
Molecular FormulaC13H20N2O3S
Molecular Weight284.38 g/mol
Exact Mass284.12
IUPAC Name2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide
SMILESCCC(C)(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1C
InChIInChI=1S/C13H20N2O3S/c1-5-13(3,4)12(16)15-11-8-10(19(14,17)18)7-6-9(11)2/h6-8H,5H2,1-4H3,(H,15,16)(H2,14,17,18)
InChIKeyFVBDXUSSYZJOHI-UHFFFAOYSA-N
XLogP2.02
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-fluoro-5-sulfamoylphenyl)-2,2-dimethylbutanamide
CID 62677323
ethyl N-(2-methyl-5-sulfamoylphenyl)carbamate
CID 61063184
3,3,3-trifluoro-N-(2-methyl-5-sulfamoylphenyl)propanamide
CID 61130873
2-amino-2-methyl-N-(2-methyl-5-methylsulfonylphenyl)pentanamide
CID 60846841
N-(2-chloro-6-methyl-4-sulfamoylphenyl)-2,2-dimethylbutanamide
CID 66256512
3-chloro-2-methyl-N-(2-methyl-5-sulfamoylphenyl)propanamide
CID 62727205
N-(5-cyano-2-methylphenyl)-2,2-dimethylbutanamide
CID 62678428
2-cyano-N-(2-methyl-5-sulfamoylphenyl)acetamide
CID 168521039
2,2-dimethyl-N-(3-methyl-4-sulfamoylphenyl)butanamide
CID 62677678
(2-methyl-5-sulfamoylphenyl)thiourea
CID 169356925
3-chloro-N-[5-(dimethylsulfamoyl)-2-methylphenyl]-2,2-dimethylpropanamide
CID 63678439
2-(cyclopropylmethylamino)-N-(2-methyl-5-sulfamoylphenyl)acetamide
CID 60866226

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide?
The IUPAC name of 2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide (CID 55103402) is 2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide.
What is the SMILES notation for 2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide?
The canonical SMILES for 2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide is CCC(C)(C)C(=O)Nc1cc(S(N)(=O)=O)ccc1C.
What is the InChIKey of 2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide?
The InChIKey is FVBDXUSSYZJOHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3S/c1-5-13(3,4)12(16)15-11-8-10(19(14,17)18)7-6-9(11)2/h6-8H,5H2,1-4H3,(H,15,16)(H2,14,17,18).
What are the key properties of 2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide?
2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide has a molecular weight of 284.38 g/mol, XLogP of 2.02, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide is sourced from PubChem (CID 55103402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).