N-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide

C13H14N2O4S — CID 61249722

IUPACN-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide
SMILESCOCc1ccccc1NS(=O)(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C13H14N2O4S/c1-19-9-10-4-2-3-5-12(10)15-20(17,18)11-6-7-13(16)14-8-11/h2-8,15H,9H2,1H3,(H,14,16)
InChIKeyNVRQMJILPSDRIY-UHFFFAOYSA-N
MW294.33 g/mol
LogP1.32
Rot. Bonds5

About N-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide

N-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide (PubChem CID 61249722) has the molecular formula C13H14N2O4S and a molecular weight of 294.33 g/mol. Its IUPAC name is N-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide
PubChem CID61249722
Molecular FormulaC13H14N2O4S
Molecular Weight294.33 g/mol
Exact Mass294.07
IUPAC NameN-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide
SMILESCOCc1ccccc1NS(=O)(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C13H14N2O4S/c1-19-9-10-4-2-3-5-12(10)15-20(17,18)11-6-7-13(16)14-8-11/h2-8,15H,9H2,1H3,(H,14,16)
InChIKeyNVRQMJILPSDRIY-UHFFFAOYSA-N
XLogP1.32
TPSA88.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide
CID 64607514
N-(2-ethyl-6-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 43629071
N-[2-(methoxymethyl)phenyl]-2-(methylamino)pyrimidine-5-sulfonamide
CID 62151716
2-bromo-N-[2-(methoxymethyl)phenyl]benzenesulfonamide
CID 47310105
N-(4-methoxy-2-methylphenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 62873560
1-chloro-N-[2-(methoxymethyl)phenyl]methanesulfonamide
CID 63664132
N-(2,3-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 61075597
N-[(2-hydroxyphenyl)methyl]-6-oxo-1H-pyridine-3-sulfonamide
CID 114332748
N-(2,3-dichlorophenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 43629246
4-fluoro-N-[2-(2-methoxyethyl)phenyl]benzenesulfonamide
CID 102846903
N-[2-(methoxymethyl)phenyl]-2-methyl-1H-imidazole-5-sulfonamide
CID 62999128
N-[2-(methoxymethyl)phenyl]-5-(methylaminomethyl)furan-2-sulfonamide
CID 106003230

Frequently Asked Questions

What is the IUPAC name of N-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide?
The IUPAC name of N-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide (CID 61249722) is N-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide.
What is the SMILES notation for N-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide?
The canonical SMILES for N-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide is COCc1ccccc1NS(=O)(=O)c1ccc(=O)[nH]c1.
What is the InChIKey of N-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide?
The InChIKey is NVRQMJILPSDRIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O4S/c1-19-9-10-4-2-3-5-12(10)15-20(17,18)11-6-7-13(16)14-8-11/h2-8,15H,9H2,1H3,(H,14,16).
What are the key properties of N-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide?
N-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide has a molecular weight of 294.33 g/mol, XLogP of 1.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide is sourced from PubChem (CID 61249722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).