N-(4-ethoxyphenyl)-N-methylpyridine-3-sulfonamide

C14H16N2O3S — CID 56794329

IUPACN-(4-ethoxyphenyl)-N-methylpyridine-3-sulfonamide
SMILESCCOc1ccc(N(C)S(=O)(=O)c2cccnc2)cc1
InChIInChI=1S/C14H16N2O3S/c1-3-19-13-8-6-12(7-9-13)16(2)20(17,18)14-5-4-10-15-11-14/h4-11H,3H2,1-2H3
InChIKeyAUYGEAMEEGDPMA-UHFFFAOYSA-N
MW292.36 g/mol
LogP2.31
Rot. Bonds5

About N-(4-ethoxyphenyl)-N-methylpyridine-3-sulfonamide

N-(4-ethoxyphenyl)-N-methylpyridine-3-sulfonamide (PubChem CID 56794329) has the molecular formula C14H16N2O3S and a molecular weight of 292.36 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-N-methylpyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-N-methylpyridine-3-sulfonamide
PubChem CID56794329
Molecular FormulaC14H16N2O3S
Molecular Weight292.36 g/mol
Exact Mass292.09
IUPAC NameN-(4-ethoxyphenyl)-N-methylpyridine-3-sulfonamide
SMILESCCOc1ccc(N(C)S(=O)(=O)c2cccnc2)cc1
InChIInChI=1S/C14H16N2O3S/c1-3-19-13-8-6-12(7-9-13)16(2)20(17,18)14-5-4-10-15-11-14/h4-11H,3H2,1-2H3
InChIKeyAUYGEAMEEGDPMA-UHFFFAOYSA-N
XLogP2.31
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-ethoxyphenyl)-N-ethylpyridine-3-sulfonamide
CID 4105425
N-(6-amino-3-pyridinyl)-N-methylpyridine-3-sulfonamide
CID 115274544
N-(4-ethoxyphenyl)-N-methyl-4-nitrobenzenesulfonamide
CID 99705183
N'-hydroxy-4-[methyl(pyridin-3-ylsulfonyl)amino]benzenecarboximidamide
CID 76979395
N-[2-(4-ethoxyphenyl)ethyl]pyridine-3-sulfonamide
CID 25044131
2-[4-[(4-ethoxyphenyl)sulfonyl-methylamino]phenoxy]-N-methyl-N-phenylacetamide
CID 55346376
[4-[benzenesulfonyl(methyl)amino]phenyl] pyrazine-2-carboxylate
CID 18075166
4-ethoxy-N-(3-fluorophenyl)-N-methylbenzenesulfonamide
CID 99695461
N-(4-ethoxyphenyl)-3-fluoro-4-methoxy-N-methylbenzenesulfonamide
CID 99705186
N-cyclopropyl-4-ethoxy-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 51204434
N-methyl-N-[4-(pyridine-3-carbonyl)phenyl]benzenesulfonamide
CID 10066599
ethyl pyridine-3-sulfonate
CID 156789856

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-N-methylpyridine-3-sulfonamide?
The IUPAC name of N-(4-ethoxyphenyl)-N-methylpyridine-3-sulfonamide (CID 56794329) is N-(4-ethoxyphenyl)-N-methylpyridine-3-sulfonamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-N-methylpyridine-3-sulfonamide?
The canonical SMILES for N-(4-ethoxyphenyl)-N-methylpyridine-3-sulfonamide is CCOc1ccc(N(C)S(=O)(=O)c2cccnc2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-N-methylpyridine-3-sulfonamide?
The InChIKey is AUYGEAMEEGDPMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c1-3-19-13-8-6-12(7-9-13)16(2)20(17,18)14-5-4-10-15-11-14/h4-11H,3H2,1-2H3.
What are the key properties of N-(4-ethoxyphenyl)-N-methylpyridine-3-sulfonamide?
N-(4-ethoxyphenyl)-N-methylpyridine-3-sulfonamide has a molecular weight of 292.36 g/mol, XLogP of 2.31, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-N-methylpyridine-3-sulfonamide is sourced from PubChem (CID 56794329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).