N-methyl-3-methylsulfonyl-N-[(2-phenylphenyl)methyl]benzamide

C22H21NO3S — CID 60618534

IUPACN-methyl-3-methylsulfonyl-N-[(2-phenylphenyl)methyl]benzamide
SMILESCN(Cc1ccccc1-c1ccccc1)C(=O)c1cccc(S(C)(=O)=O)c1
InChIInChI=1S/C22H21NO3S/c1-23(22(24)18-12-8-13-20(15-18)27(2,25)26)16-19-11-6-7-14-21(19)17-9-4-3-5-10-17/h3-15H,16H2,1-2H3
InChIKeyZPJMKSUQALLNIZ-UHFFFAOYSA-N
MW379.48 g/mol
LogP4.03
Rot. Bonds5

About N-methyl-3-methylsulfonyl-N-[(2-phenylphenyl)methyl]benzamide

N-methyl-3-methylsulfonyl-N-[(2-phenylphenyl)methyl]benzamide (PubChem CID 60618534) has the molecular formula C22H21NO3S and a molecular weight of 379.48 g/mol. Its IUPAC name is N-methyl-3-methylsulfonyl-N-[(2-phenylphenyl)methyl]benzamide.

Molecular Properties

Compound NameN-methyl-3-methylsulfonyl-N-[(2-phenylphenyl)methyl]benzamide
PubChem CID60618534
Molecular FormulaC22H21NO3S
Molecular Weight379.48 g/mol
Exact Mass379.12
IUPAC NameN-methyl-3-methylsulfonyl-N-[(2-phenylphenyl)methyl]benzamide
SMILESCN(Cc1ccccc1-c1ccccc1)C(=O)c1cccc(S(C)(=O)=O)c1
InChIInChI=1S/C22H21NO3S/c1-23(22(24)18-12-8-13-20(15-18)27(2,25)26)16-19-11-6-7-14-21(19)17-9-4-3-5-10-17/h3-15H,16H2,1-2H3
InChIKeyZPJMKSUQALLNIZ-UHFFFAOYSA-N
XLogP4.03
TPSA54.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.48
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-methyl-3-methylsulfonyl-N-[(2-phenylphenyl)methyl]benzamide 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-(3-methylsulfonylbenzoyl)amino]acetic acid
CID 16777539
N-methyl-3-methylsulfonyl-N-(thiophen-3-ylmethyl)benzamide
CID 18117252
N-methyl-3-methylsulfonyl-N-(2-naphthalen-1-ylethyl)benzamide
CID 60619049
N-methyl-3-methylsulfonyl-N-(2-phenoxyethyl)benzamide
CID 27822055
N-[(4-methoxyphenyl)methyl]-N-methyl-3-methylsulfonylbenzamide
CID 39972148
N-(2-methoxyethyl)-N-methyl-3-methylsulfonylbenzamide
CID 69372704
N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-3-methylsulfonylbenzamide
CID 18111551
N-methyl-3-methylsulfonyl-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]benzamide
CID 64511771
N-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-5-(3-methylsulfonylphenyl)naphthalene-2-carboxamide
CID 172669663
N-[(2-bromophenyl)methyl]-3-[(2-fluorophenyl)sulfamoyl]-N-methylbenzamide
CID 30288210
3-(dimethylsulfamoyl)-N-methyl-N-[[2-(trifluoromethoxy)phenyl]methyl]benzamide
CID 38072733
N-[(2-chlorophenyl)methyl]-N-methyl-3-[methyl-(4-methylphenyl)sulfamoyl]benzamide
CID 26731966

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-methylsulfonyl-N-[(2-phenylphenyl)methyl]benzamide?
The IUPAC name of N-methyl-3-methylsulfonyl-N-[(2-phenylphenyl)methyl]benzamide (CID 60618534) is N-methyl-3-methylsulfonyl-N-[(2-phenylphenyl)methyl]benzamide.
What is the SMILES notation for N-methyl-3-methylsulfonyl-N-[(2-phenylphenyl)methyl]benzamide?
The canonical SMILES for N-methyl-3-methylsulfonyl-N-[(2-phenylphenyl)methyl]benzamide is CN(Cc1ccccc1-c1ccccc1)C(=O)c1cccc(S(C)(=O)=O)c1.
What is the InChIKey of N-methyl-3-methylsulfonyl-N-[(2-phenylphenyl)methyl]benzamide?
The InChIKey is ZPJMKSUQALLNIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO3S/c1-23(22(24)18-12-8-13-20(15-18)27(2,25)26)16-19-11-6-7-14-21(19)17-9-4-3-5-10-17/h3-15H,16H2,1-2H3.
What are the key properties of N-methyl-3-methylsulfonyl-N-[(2-phenylphenyl)methyl]benzamide?
N-methyl-3-methylsulfonyl-N-[(2-phenylphenyl)methyl]benzamide has a molecular weight of 379.48 g/mol, XLogP of 4.03, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-methylsulfonyl-N-[(2-phenylphenyl)methyl]benzamide is sourced from PubChem (CID 60618534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).