(2S,3S)-N-[4-(dimethylsulfamoyl)phenyl]-3-methyl-2-phenylpentanamide

C20H26N2O3S — CID 25484071

IUPAC(2S,3S)-N-[4-(dimethylsulfamoyl)phenyl]-3-methyl-2-phenylpentanamide
SMILESCC[C@H](C)[C@H](C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1)c1ccccc1
InChIInChI=1S/C20H26N2O3S/c1-5-15(2)19(16-9-7-6-8-10-16)20(23)21-17-11-13-18(14-12-17)26(24,25)22(3)4/h6-15,19H,5H2,1-4H3,(H,21,23)/t15-,19-/m0/s1
InChIKeyIBNGMHMDVQODHB-KXBFYZLASA-N
MW374.51 g/mol
LogP3.71
Rot. Bonds7

About (2S,3S)-N-[4-(dimethylsulfamoyl)phenyl]-3-methyl-2-phenylpentanamide

(2S,3S)-N-[4-(dimethylsulfamoyl)phenyl]-3-methyl-2-phenylpentanamide (PubChem CID 25484071) has the molecular formula C20H26N2O3S and a molecular weight of 374.51 g/mol. Its IUPAC name is (2S,3S)-N-[4-(dimethylsulfamoyl)phenyl]-3-methyl-2-phenylpentanamide.

Molecular Properties

Compound Name(2S,3S)-N-[4-(dimethylsulfamoyl)phenyl]-3-methyl-2-phenylpentanamide
PubChem CID25484071
Molecular FormulaC20H26N2O3S
Molecular Weight374.51 g/mol
Exact Mass374.17
IUPAC Name(2S,3S)-N-[4-(dimethylsulfamoyl)phenyl]-3-methyl-2-phenylpentanamide
SMILESCC[C@H](C)[C@H](C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1)c1ccccc1
InChIInChI=1S/C20H26N2O3S/c1-5-15(2)19(16-9-7-6-8-10-16)20(23)21-17-11-13-18(14-12-17)26(24,25)22(3)4/h6-15,19H,5H2,1-4H3,(H,21,23)/t15-,19-/m0/s1
InChIKeyIBNGMHMDVQODHB-KXBFYZLASA-N
XLogP3.71
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2S,3S)-N-[4-(dimethylsulfamoyl)phenyl]-3-methyl-2-phenylpentanamide 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-[4-(dimethylsulfamoyl)phenyl]-2-phenylbutanamide
CID 6465200
N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-3-methyl-2-phenylpentanamide
CID 55396360
[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl] (2R)-2-phenylbutanoate
CID 7811085
(2S,3S)-N-[4-(difluoromethoxy)phenyl]-3-methyl-2-phenylpentanamide
CID 8502612
(2R,3S)-N-[4-(2-amino-2-oxoethyl)phenyl]-3-methyl-2-phenylpentanamide
CID 95310454
[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]-[(1S)-1-phenylethyl]azanium
CID 8897553
(2R,3R)-N-(1,3-benzodioxol-5-yl)-3-methyl-2-phenylpentanamide
CID 8700986
N-[3-[(dimethylamino)methyl]phenyl]-3-methyl-2-phenylpentanamide
CID 78862850
N-[4-(dimethylsulfamoyl)phenyl]-2-phenylsulfanylacetamide
CID 2082856
[2-oxo-2-(4-sulfamoylanilino)ethyl] (2R,3R)-3-methyl-2-phenylpentanoate
CID 7772394
N-(2-anilino-2-oxo-1-phenylethyl)-4-(dimethylsulfamoyl)benzamide
CID 55779161
(2S,3S)-N-[4-[(2,5-dioxopyrrolidin-1-yl)methyl]phenyl]-3-methyl-2-phenylpentanamide
CID 51933857

Frequently Asked Questions

What is the IUPAC name of (2S,3S)-N-[4-(dimethylsulfamoyl)phenyl]-3-methyl-2-phenylpentanamide?
The IUPAC name of (2S,3S)-N-[4-(dimethylsulfamoyl)phenyl]-3-methyl-2-phenylpentanamide (CID 25484071) is (2S,3S)-N-[4-(dimethylsulfamoyl)phenyl]-3-methyl-2-phenylpentanamide.
What is the SMILES notation for (2S,3S)-N-[4-(dimethylsulfamoyl)phenyl]-3-methyl-2-phenylpentanamide?
The canonical SMILES for (2S,3S)-N-[4-(dimethylsulfamoyl)phenyl]-3-methyl-2-phenylpentanamide is CC[C@H](C)[C@H](C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1)c1ccccc1.
What is the InChIKey of (2S,3S)-N-[4-(dimethylsulfamoyl)phenyl]-3-methyl-2-phenylpentanamide?
The InChIKey is IBNGMHMDVQODHB-KXBFYZLASA-N. The full InChI is InChI=1S/C20H26N2O3S/c1-5-15(2)19(16-9-7-6-8-10-16)20(23)21-17-11-13-18(14-12-17)26(24,25)22(3)4/h6-15,19H,5H2,1-4H3,(H,21,23)/t15-,19-/m0/s1.
What are the key properties of (2S,3S)-N-[4-(dimethylsulfamoyl)phenyl]-3-methyl-2-phenylpentanamide?
(2S,3S)-N-[4-(dimethylsulfamoyl)phenyl]-3-methyl-2-phenylpentanamide has a molecular weight of 374.51 g/mol, XLogP of 3.71, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S)-N-[4-(dimethylsulfamoyl)phenyl]-3-methyl-2-phenylpentanamide is sourced from PubChem (CID 25484071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).