N-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide

C15H16N2O4S — CID 35368167

IUPACN-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide
SMILESCOc1cccc(C(=O)Nc2ccccc2NS(C)(=O)=O)c1
InChIInChI=1S/C15H16N2O4S/c1-21-12-7-5-6-11(10-12)15(18)16-13-8-3-4-9-14(13)17-22(2,19)20/h3-10,17H,1-2H3,(H,16,18)
InChIKeySITSVIPJUFHSBJ-UHFFFAOYSA-N
MW320.37 g/mol
LogP2.32
Rot. Bonds5

About N-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide

N-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide (PubChem CID 35368167) has the molecular formula C15H16N2O4S and a molecular weight of 320.37 g/mol. Its IUPAC name is N-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide.

Molecular Properties

Compound NameN-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide
PubChem CID35368167
Molecular FormulaC15H16N2O4S
Molecular Weight320.37 g/mol
Exact Mass320.08
IUPAC NameN-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide
SMILESCOc1cccc(C(=O)Nc2ccccc2NS(C)(=O)=O)c1
InChIInChI=1S/C15H16N2O4S/c1-21-12-7-5-6-11(10-12)15(18)16-13-8-3-4-9-14(13)17-22(2,19)20/h3-10,17H,1-2H3,(H,16,18)
InChIKeySITSVIPJUFHSBJ-UHFFFAOYSA-N
XLogP2.32
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.37
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide?
The IUPAC name of N-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide (CID 35368167) is N-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide.
What is the SMILES notation for N-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide?
The canonical SMILES for N-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide is COc1cccc(C(=O)Nc2ccccc2NS(C)(=O)=O)c1.
What is the InChIKey of N-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide?
The InChIKey is SITSVIPJUFHSBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O4S/c1-21-12-7-5-6-11(10-12)15(18)16-13-8-3-4-9-14(13)17-22(2,19)20/h3-10,17H,1-2H3,(H,16,18).
What are the key properties of N-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide?
N-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide has a molecular weight of 320.37 g/mol, XLogP of 2.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methanesulfonamido)phenyl]-3-methoxybenzamide is sourced from PubChem (CID 35368167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).