N-(2-ethoxyphenyl)pyridine-3-sulfonamide

C13H14N2O3S — CID 3622022

IUPACN-(2-ethoxyphenyl)pyridine-3-sulfonamide
SMILESCCOc1ccccc1NS(=O)(=O)c1cccnc1
InChIInChI=1S/C13H14N2O3S/c1-2-18-13-8-4-3-7-12(13)15-19(16,17)11-6-5-9-14-10-11/h3-10,15H,2H2,1H3
InChIKeySJZCMLIJCQBDKA-UHFFFAOYSA-N
MW278.33 g/mol
LogP2.28
Rot. Bonds5

About N-(2-ethoxyphenyl)pyridine-3-sulfonamide

N-(2-ethoxyphenyl)pyridine-3-sulfonamide (PubChem CID 3622022) has the molecular formula C13H14N2O3S and a molecular weight of 278.33 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)pyridine-3-sulfonamide
PubChem CID3622022
Molecular FormulaC13H14N2O3S
Molecular Weight278.33 g/mol
Exact Mass278.07
IUPAC NameN-(2-ethoxyphenyl)pyridine-3-sulfonamide
SMILESCCOc1ccccc1NS(=O)(=O)c1cccnc1
InChIInChI=1S/C13H14N2O3S/c1-2-18-13-8-4-3-7-12(13)15-19(16,17)11-6-5-9-14-10-11/h3-10,15H,2H2,1H3
InChIKeySJZCMLIJCQBDKA-UHFFFAOYSA-N
XLogP2.28
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)pyridine-3-sulfonamide?
The IUPAC name of N-(2-ethoxyphenyl)pyridine-3-sulfonamide (CID 3622022) is N-(2-ethoxyphenyl)pyridine-3-sulfonamide.
What is the SMILES notation for N-(2-ethoxyphenyl)pyridine-3-sulfonamide?
The canonical SMILES for N-(2-ethoxyphenyl)pyridine-3-sulfonamide is CCOc1ccccc1NS(=O)(=O)c1cccnc1.
What is the InChIKey of N-(2-ethoxyphenyl)pyridine-3-sulfonamide?
The InChIKey is SJZCMLIJCQBDKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3S/c1-2-18-13-8-4-3-7-12(13)15-19(16,17)11-6-5-9-14-10-11/h3-10,15H,2H2,1H3.
What are the key properties of N-(2-ethoxyphenyl)pyridine-3-sulfonamide?
N-(2-ethoxyphenyl)pyridine-3-sulfonamide has a molecular weight of 278.33 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)pyridine-3-sulfonamide is sourced from PubChem (CID 3622022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).