N-benzyl-N-(2-methoxyphenyl)methanesulfonamide

C15H17NO3S — CID 6459309

IUPACN-benzyl-N-(2-methoxyphenyl)methanesulfonamide
SMILESCOc1ccccc1N(Cc1ccccc1)S(C)(=O)=O
InChIInChI=1S/C15H17NO3S/c1-19-15-11-7-6-10-14(15)16(20(2,17)18)12-13-8-4-3-5-9-13/h3-11H,12H2,1-2H3
InChIKeyNVODWVWVEUUFPZ-UHFFFAOYSA-N
MW291.37 g/mol
LogP2.66
Rot. Bonds5

About N-benzyl-N-(2-methoxyphenyl)methanesulfonamide

N-benzyl-N-(2-methoxyphenyl)methanesulfonamide (PubChem CID 6459309) has the molecular formula C15H17NO3S and a molecular weight of 291.37 g/mol. Its IUPAC name is N-benzyl-N-(2-methoxyphenyl)methanesulfonamide.

Molecular Properties

Compound NameN-benzyl-N-(2-methoxyphenyl)methanesulfonamide
PubChem CID6459309
Molecular FormulaC15H17NO3S
Molecular Weight291.37 g/mol
Exact Mass291.09
IUPAC NameN-benzyl-N-(2-methoxyphenyl)methanesulfonamide
SMILESCOc1ccccc1N(Cc1ccccc1)S(C)(=O)=O
InChIInChI=1S/C15H17NO3S/c1-19-15-11-7-6-10-14(15)16(20(2,17)18)12-13-8-4-3-5-9-13/h3-11H,12H2,1-2H3
InChIKeyNVODWVWVEUUFPZ-UHFFFAOYSA-N
XLogP2.66
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.37
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-benzyl-N-(2-methoxyphenyl)benzenesulfonamide
CID 100591343
2-[benzyl-[2-(2-methoxy-N-methylsulfonylanilino)acetyl]amino]-N-ethylbutanamide
CID 132676218
2-[benzyl(methylsulfonyl)amino]-N-(3,4-dimethoxyphenyl)benzamide
CID 1107755
2-[benzyl-[2-(2-methoxy-N-methylsulfonylanilino)acetyl]amino]-3-phenyl-N-propylpropanamide
CID 132624833
N-benzyl-4-(2-methoxy-N-methylsulfonylanilino)-N-[(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide
CID 100646538
N-benzyl-N-phenylmethanesulfonamide;ethane
CID 142134956
N-(2-methoxyphenyl)-N-methylmethanesulfonamide
CID 61061885
2-amino-N-benzyl-N-(2-methoxyphenyl)acetamide
CID 39369464
N-benzyl-N-[1-(ethylamino)-1-oxopropan-2-yl]-4-(2-methoxy-N-methylsulfonylanilino)butanamide
CID 132944111
(2S)-2-[benzyl-[4-(2-methoxy-N-methylsulfonylanilino)butanoyl]amino]-N-propylbutanamide
CID 100542387
2-[benzyl(methylsulfonyl)amino]-N-[(2-hydroxy-3-methoxyphenyl)methylideneamino]benzamide
CID 5076592
2-[benzyl-[4-(2-methoxy-N-methylsulfonylanilino)butanoyl]amino]-N-methylbutanamide
CID 132944084

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(2-methoxyphenyl)methanesulfonamide?
The IUPAC name of N-benzyl-N-(2-methoxyphenyl)methanesulfonamide (CID 6459309) is N-benzyl-N-(2-methoxyphenyl)methanesulfonamide.
What is the SMILES notation for N-benzyl-N-(2-methoxyphenyl)methanesulfonamide?
The canonical SMILES for N-benzyl-N-(2-methoxyphenyl)methanesulfonamide is COc1ccccc1N(Cc1ccccc1)S(C)(=O)=O.
What is the InChIKey of N-benzyl-N-(2-methoxyphenyl)methanesulfonamide?
The InChIKey is NVODWVWVEUUFPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3S/c1-19-15-11-7-6-10-14(15)16(20(2,17)18)12-13-8-4-3-5-9-13/h3-11H,12H2,1-2H3.
What are the key properties of N-benzyl-N-(2-methoxyphenyl)methanesulfonamide?
N-benzyl-N-(2-methoxyphenyl)methanesulfonamide has a molecular weight of 291.37 g/mol, XLogP of 2.66, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(2-methoxyphenyl)methanesulfonamide is sourced from PubChem (CID 6459309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).