(2S)-N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-methylbutanamide

C19H32N2O3S — CID 40932274

IUPAC(2S)-N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-methylbutanamide
SMILESCC[C@H](C)C(=O)Nc1ccc(S(=O)(=O)N(CC(C)C)CC(C)C)cc1
InChIInChI=1S/C19H32N2O3S/c1-7-16(6)19(22)20-17-8-10-18(11-9-17)25(23,24)21(12-14(2)3)13-15(4)5/h8-11,14-16H,7,12-13H2,1-6H3,(H,20,22)/t16-/m0/s1
InChIKeyUREKUNZVTDSAQU-INIZCTEOSA-N
MW368.54 g/mol
LogP3.97
Rot. Bonds9

About (2S)-N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-methylbutanamide

(2S)-N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-methylbutanamide (PubChem CID 40932274) has the molecular formula C19H32N2O3S and a molecular weight of 368.54 g/mol. Its IUPAC name is (2S)-N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-methylbutanamide.

Molecular Properties

Compound Name(2S)-N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-methylbutanamide
PubChem CID40932274
Molecular FormulaC19H32N2O3S
Molecular Weight368.54 g/mol
Exact Mass368.21
IUPAC Name(2S)-N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-methylbutanamide
SMILESCC[C@H](C)C(=O)Nc1ccc(S(=O)(=O)N(CC(C)C)CC(C)C)cc1
InChIInChI=1S/C19H32N2O3S/c1-7-16(6)19(22)20-17-8-10-18(11-9-17)25(23,24)21(12-14(2)3)13-15(4)5/h8-11,14-16H,7,12-13H2,1-6H3,(H,20,22)/t16-/m0/s1
InChIKeyUREKUNZVTDSAQU-INIZCTEOSA-N
XLogP3.97
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.54
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2S)-N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-methylbutanamide 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

2-methyl-N-(4-methylsulfonylphenyl)butanamide
CID 51331498
ethyl 2-[4-[bis(2-methylpropyl)sulfamoyl]anilino]-2-oxoacetate
CID 17311755
2-bromo-N-[4-(diethylsulfamoyl)phenyl]propanamide
CID 107903298
N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2,6-dichlorobenzamide
CID 17311636
N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-(4-chlorophenyl)acetamide
CID 17311776
N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-chlorobenzamide
CID 17311380
4-[bis(2-methylpropyl)sulfamoyl]-N-[4-(trifluoromethyl)phenyl]benzamide
CID 71464436
(2S)-N-(4-acetamidophenyl)-2-methylbutanamide
CID 837961
N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-3-(propanoylamino)benzamide
CID 17312368
N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-(4-nitrophenyl)acetamide
CID 17311686
4-ethyl-N,N-bis(2-methylpropyl)benzenesulfonamide
CID 19682262
3-benzylsulfonyl-N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]propanamide
CID 17312270

Frequently Asked Questions

What is the IUPAC name of (2S)-N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-methylbutanamide?
The IUPAC name of (2S)-N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-methylbutanamide (CID 40932274) is (2S)-N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-methylbutanamide.
What is the SMILES notation for (2S)-N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-methylbutanamide?
The canonical SMILES for (2S)-N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-methylbutanamide is CC[C@H](C)C(=O)Nc1ccc(S(=O)(=O)N(CC(C)C)CC(C)C)cc1.
What is the InChIKey of (2S)-N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-methylbutanamide?
The InChIKey is UREKUNZVTDSAQU-INIZCTEOSA-N. The full InChI is InChI=1S/C19H32N2O3S/c1-7-16(6)19(22)20-17-8-10-18(11-9-17)25(23,24)21(12-14(2)3)13-15(4)5/h8-11,14-16H,7,12-13H2,1-6H3,(H,20,22)/t16-/m0/s1.
What are the key properties of (2S)-N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-methylbutanamide?
(2S)-N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-methylbutanamide has a molecular weight of 368.54 g/mol, XLogP of 3.97, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-2-methylbutanamide is sourced from PubChem (CID 40932274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).