2-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-phenylpropanamide

C18H23N3O3S — CID 119263742

IUPAC2-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-phenylpropanamide
SMILESCc1ccc(NC(=O)C(N)Cc2ccccc2)cc1S(=O)(=O)N(C)C
InChIInChI=1S/C18H23N3O3S/c1-13-9-10-15(12-17(13)25(23,24)21(2)3)20-18(22)16(19)11-14-7-5-4-6-8-14/h4-10,12,16H,11,19H2,1-3H3,(H,20,22)
InChIKeyBDSPNGSTBPRITF-UHFFFAOYSA-N
MW361.47 g/mol
LogP1.75
Rot. Bonds6

About 2-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-phenylpropanamide

2-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-phenylpropanamide (PubChem CID 119263742) has the molecular formula C18H23N3O3S and a molecular weight of 361.47 g/mol. Its IUPAC name is 2-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-phenylpropanamide
PubChem CID119263742
Molecular FormulaC18H23N3O3S
Molecular Weight361.47 g/mol
Exact Mass361.15
IUPAC Name2-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-phenylpropanamide
SMILESCc1ccc(NC(=O)C(N)Cc2ccccc2)cc1S(=O)(=O)N(C)C
InChIInChI=1S/C18H23N3O3S/c1-13-9-10-15(12-17(13)25(23,24)21(2)3)20-18(22)16(19)11-14-7-5-4-6-8-14/h4-10,12,16H,11,19H2,1-3H3,(H,20,22)
InChIKeyBDSPNGSTBPRITF-UHFFFAOYSA-N
XLogP1.75
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.47
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-phenylpropanamide 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-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]butanamide
CID 61259264
(2S)-2-amino-N-[3-(tert-butylsulfamoyl)-4-methylphenyl]-3-phenylpropanamide
CID 119332400
(2R)-2-amino-N-(3-iodo-4-methylphenyl)-3-phenylpropanamide
CID 78985668
N-[1-[3-(dimethylsulfamoyl)-4-methylanilino]-1-oxo-3-phenylpropan-2-yl]thiophene-2-carboxamide
CID 24635520
3-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-phenylpropanamide;hydrochloride
CID 119675164
2-amino-N-(3-bromo-4-methylphenyl)-3-phenylpropanamide
CID 63334484
(2S)-2-amino-N-(3-bromo-4-methylphenyl)-3-phenylpropanamide
CID 22691230
3-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-methylpropanamide
CID 62670776
(2S)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-phenoxypropanamide
CID 7812070
2-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-methylpentanamide;hydrochloride
CID 119675207
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-phenoxypropanamide
CID 5138475
(2R)-2-amino-N-(4-fluoro-3-methylphenyl)-3-phenylpropanamide
CID 78917568

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-phenylpropanamide?
The IUPAC name of 2-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-phenylpropanamide (CID 119263742) is 2-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-phenylpropanamide.
What is the SMILES notation for 2-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-phenylpropanamide?
The canonical SMILES for 2-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-phenylpropanamide is Cc1ccc(NC(=O)C(N)Cc2ccccc2)cc1S(=O)(=O)N(C)C.
What is the InChIKey of 2-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-phenylpropanamide?
The InChIKey is BDSPNGSTBPRITF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O3S/c1-13-9-10-15(12-17(13)25(23,24)21(2)3)20-18(22)16(19)11-14-7-5-4-6-8-14/h4-10,12,16H,11,19H2,1-3H3,(H,20,22).
What are the key properties of 2-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-phenylpropanamide?
2-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-phenylpropanamide has a molecular weight of 361.47 g/mol, XLogP of 1.75, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-3-phenylpropanamide is sourced from PubChem (CID 119263742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).