N-[(2-fluorophenyl)methyl]-N-(3-methylphenyl)methanesulfonamide

C15H16FNO2S — CID 966907

IUPACN-[(2-fluorophenyl)methyl]-N-(3-methylphenyl)methanesulfonamide
SMILESCc1cccc(N(Cc2ccccc2F)S(C)(=O)=O)c1
InChIInChI=1S/C15H16FNO2S/c1-12-6-5-8-14(10-12)17(20(2,18)19)11-13-7-3-4-9-15(13)16/h3-10H,11H2,1-2H3
InChIKeyCZBNTZFANNKUDR-UHFFFAOYSA-N
MW293.36 g/mol
LogP3.10
Rot. Bonds4

About N-[(2-fluorophenyl)methyl]-N-(3-methylphenyl)methanesulfonamide

N-[(2-fluorophenyl)methyl]-N-(3-methylphenyl)methanesulfonamide (PubChem CID 966907) has the molecular formula C15H16FNO2S and a molecular weight of 293.36 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]-N-(3-methylphenyl)methanesulfonamide.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]-N-(3-methylphenyl)methanesulfonamide
PubChem CID966907
Molecular FormulaC15H16FNO2S
Molecular Weight293.36 g/mol
Exact Mass293.09
IUPAC NameN-[(2-fluorophenyl)methyl]-N-(3-methylphenyl)methanesulfonamide
SMILESCc1cccc(N(Cc2ccccc2F)S(C)(=O)=O)c1
InChIInChI=1S/C15H16FNO2S/c1-12-6-5-8-14(10-12)17(20(2,18)19)11-13-7-3-4-9-15(13)16/h3-10H,11H2,1-2H3
InChIKeyCZBNTZFANNKUDR-UHFFFAOYSA-N
XLogP3.10
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.36
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-[(2-fluorophenyl)methyl]-N-(3-methylphenyl)methanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]-N-(3-methylphenyl)methanesulfonamide?
The IUPAC name of N-[(2-fluorophenyl)methyl]-N-(3-methylphenyl)methanesulfonamide (CID 966907) is N-[(2-fluorophenyl)methyl]-N-(3-methylphenyl)methanesulfonamide.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]-N-(3-methylphenyl)methanesulfonamide?
The canonical SMILES for N-[(2-fluorophenyl)methyl]-N-(3-methylphenyl)methanesulfonamide is Cc1cccc(N(Cc2ccccc2F)S(C)(=O)=O)c1.
What is the InChIKey of N-[(2-fluorophenyl)methyl]-N-(3-methylphenyl)methanesulfonamide?
The InChIKey is CZBNTZFANNKUDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO2S/c1-12-6-5-8-14(10-12)17(20(2,18)19)11-13-7-3-4-9-15(13)16/h3-10H,11H2,1-2H3.
What are the key properties of N-[(2-fluorophenyl)methyl]-N-(3-methylphenyl)methanesulfonamide?
N-[(2-fluorophenyl)methyl]-N-(3-methylphenyl)methanesulfonamide has a molecular weight of 293.36 g/mol, XLogP of 3.10, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methyl]-N-(3-methylphenyl)methanesulfonamide is sourced from PubChem (CID 966907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).