N-tert-butyl-2-[N-(dimethylsulfamoyl)anilino]acetamide

C14H23N3O3S — CID 3963871

IUPACN-tert-butyl-2-[N-(dimethylsulfamoyl)anilino]acetamide
SMILESCN(C)S(=O)(=O)N(CC(=O)NC(C)(C)C)c1ccccc1
InChIInChI=1S/C14H23N3O3S/c1-14(2,3)15-13(18)11-17(21(19,20)16(4)5)12-9-7-6-8-10-12/h6-10H,11H2,1-5H3,(H,15,18)
InChIKeyXCOVJDAYWZETDA-UHFFFAOYSA-N
MW313.42 g/mol
LogP1.21
Rot. Bonds5

About N-tert-butyl-2-[N-(dimethylsulfamoyl)anilino]acetamide

N-tert-butyl-2-[N-(dimethylsulfamoyl)anilino]acetamide (PubChem CID 3963871) has the molecular formula C14H23N3O3S and a molecular weight of 313.42 g/mol. Its IUPAC name is N-tert-butyl-2-[N-(dimethylsulfamoyl)anilino]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[N-(dimethylsulfamoyl)anilino]acetamide
PubChem CID3963871
Molecular FormulaC14H23N3O3S
Molecular Weight313.42 g/mol
Exact Mass313.15
IUPAC NameN-tert-butyl-2-[N-(dimethylsulfamoyl)anilino]acetamide
SMILESCN(C)S(=O)(=O)N(CC(=O)NC(C)(C)C)c1ccccc1
InChIInChI=1S/C14H23N3O3S/c1-14(2,3)15-13(18)11-17(21(19,20)16(4)5)12-9-7-6-8-10-12/h6-10H,11H2,1-5H3,(H,15,18)
InChIKeyXCOVJDAYWZETDA-UHFFFAOYSA-N
XLogP1.21
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.42
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-tert-butyl-2-[N-(dimethylsulfamoyl)anilino]acetamide 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-tert-butyl-2-(N-methylsulfonylanilino)acetamide
CID 51343017
2-[N-(dimethylsulfamoyl)anilino]-N-(2-methylpropyl)acetamide
CID 4600961
N-(4-acetamidophenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide
CID 17201170
2-[N-(dimethylsulfamoyl)anilino]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 15991423
2-[N-(dimethylsulfamoyl)anilino]-N-(4-methoxyphenyl)acetamide
CID 3363391
N-[1-(3,4-dimethylphenyl)ethyl]-2-[N-(dimethylsulfamoyl)anilino]acetamide
CID 132659078
2-[N-(benzenesulfonyl)-3-methylanilino]-N-tert-butylacetamide
CID 51345177
ethyl 2-[N-(dimethylsulfamoyl)anilino]acetate
CID 3546283
2-[N-(dimethylsulfamoyl)anilino]-N-[(4-methoxyphenyl)methyl]acetamide
CID 2976396
N-[3-(4-tert-butylbenzoyl)phenyl]-2-[N-(dimethylsulfamoyl)anilino]acetamide
CID 28633023
2-[N-(dimethylsulfamoyl)anilino]-N-(3-propan-2-yloxypropyl)acetamide
CID 17200342
2-[[2-[N-(dimethylsulfamoyl)anilino]acetyl]amino]-N-(1-phenylethyl)benzamide
CID 17201173

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[N-(dimethylsulfamoyl)anilino]acetamide?
The IUPAC name of N-tert-butyl-2-[N-(dimethylsulfamoyl)anilino]acetamide (CID 3963871) is N-tert-butyl-2-[N-(dimethylsulfamoyl)anilino]acetamide.
What is the SMILES notation for N-tert-butyl-2-[N-(dimethylsulfamoyl)anilino]acetamide?
The canonical SMILES for N-tert-butyl-2-[N-(dimethylsulfamoyl)anilino]acetamide is CN(C)S(=O)(=O)N(CC(=O)NC(C)(C)C)c1ccccc1.
What is the InChIKey of N-tert-butyl-2-[N-(dimethylsulfamoyl)anilino]acetamide?
The InChIKey is XCOVJDAYWZETDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3S/c1-14(2,3)15-13(18)11-17(21(19,20)16(4)5)12-9-7-6-8-10-12/h6-10H,11H2,1-5H3,(H,15,18).
What are the key properties of N-tert-butyl-2-[N-(dimethylsulfamoyl)anilino]acetamide?
N-tert-butyl-2-[N-(dimethylsulfamoyl)anilino]acetamide has a molecular weight of 313.42 g/mol, XLogP of 1.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[N-(dimethylsulfamoyl)anilino]acetamide is sourced from PubChem (CID 3963871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).