2-amino-N-[3-(methoxymethyl)phenyl]pyridine-3-sulfonamide

C13H15N3O3S — CID 62158681

IUPAC2-amino-N-[3-(methoxymethyl)phenyl]pyridine-3-sulfonamide
SMILESCOCc1cccc(NS(=O)(=O)c2cccnc2N)c1
InChIInChI=1S/C13H15N3O3S/c1-19-9-10-4-2-5-11(8-10)16-20(17,18)12-6-3-7-15-13(12)14/h2-8,16H,9H2,1H3,(H2,14,15)
InChIKeyBMWMJSSFRYMXKY-UHFFFAOYSA-N
MW293.35 g/mol
LogP1.61
Rot. Bonds5

About 2-amino-N-[3-(methoxymethyl)phenyl]pyridine-3-sulfonamide

2-amino-N-[3-(methoxymethyl)phenyl]pyridine-3-sulfonamide (PubChem CID 62158681) has the molecular formula C13H15N3O3S and a molecular weight of 293.35 g/mol. Its IUPAC name is 2-amino-N-[3-(methoxymethyl)phenyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-amino-N-[3-(methoxymethyl)phenyl]pyridine-3-sulfonamide
PubChem CID62158681
Molecular FormulaC13H15N3O3S
Molecular Weight293.35 g/mol
Exact Mass293.08
IUPAC Name2-amino-N-[3-(methoxymethyl)phenyl]pyridine-3-sulfonamide
SMILESCOCc1cccc(NS(=O)(=O)c2cccnc2N)c1
InChIInChI=1S/C13H15N3O3S/c1-19-9-10-4-2-5-11(8-10)16-20(17,18)12-6-3-7-15-13(12)14/h2-8,16H,9H2,1H3,(H2,14,15)
InChIKeyBMWMJSSFRYMXKY-UHFFFAOYSA-N
XLogP1.61
TPSA94.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.35
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-(3-chlorophenyl)pyridine-3-sulfonamide
CID 62144853
2-amino-N-(3-propan-2-ylphenyl)pyridine-3-sulfonamide
CID 62144250
4-chloro-N-[3-(methoxymethyl)phenyl]-2-methylbenzenesulfonamide
CID 87026734
5-(aminomethyl)-N-[3-(methoxymethyl)phenyl]-2-methylfuran-3-sulfonamide
CID 106002777
2-amino-N-(4-iodophenyl)pyridine-3-sulfonamide
CID 62143904
2-chloro-N-(3-ethylphenyl)pyridine-3-sulfonamide
CID 24621325
5-chloro-2-methoxy-N-[3-(methoxymethyl)phenyl]benzenesulfonamide
CID 100562486
N-(3-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide
CID 62144380
N-[3-(methoxymethyl)phenyl]-4-methylsulfanylbenzenesulfonamide
CID 95050814
2-amino-N-(1,3-benzodioxol-5-yl)pyridine-3-sulfonamide
CID 62163676
3-bromo-4-chloro-N-[3-(methoxymethyl)phenyl]benzenesulfonamide
CID 106611620
2-amino-N-(2,6-dibromo-4-methylphenyl)pyridine-3-sulfonamide
CID 62145114

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-(methoxymethyl)phenyl]pyridine-3-sulfonamide?
The IUPAC name of 2-amino-N-[3-(methoxymethyl)phenyl]pyridine-3-sulfonamide (CID 62158681) is 2-amino-N-[3-(methoxymethyl)phenyl]pyridine-3-sulfonamide.
What is the SMILES notation for 2-amino-N-[3-(methoxymethyl)phenyl]pyridine-3-sulfonamide?
The canonical SMILES for 2-amino-N-[3-(methoxymethyl)phenyl]pyridine-3-sulfonamide is COCc1cccc(NS(=O)(=O)c2cccnc2N)c1.
What is the InChIKey of 2-amino-N-[3-(methoxymethyl)phenyl]pyridine-3-sulfonamide?
The InChIKey is BMWMJSSFRYMXKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3S/c1-19-9-10-4-2-5-11(8-10)16-20(17,18)12-6-3-7-15-13(12)14/h2-8,16H,9H2,1H3,(H2,14,15).
What are the key properties of 2-amino-N-[3-(methoxymethyl)phenyl]pyridine-3-sulfonamide?
2-amino-N-[3-(methoxymethyl)phenyl]pyridine-3-sulfonamide has a molecular weight of 293.35 g/mol, XLogP of 1.61, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-(methoxymethyl)phenyl]pyridine-3-sulfonamide is sourced from PubChem (CID 62158681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).