3-(ethylamino)-N-(oxan-3-yl)pyridine-2-sulfonamide

C12H19N3O3S — CID 103305993

IUPAC3-(ethylamino)-N-(oxan-3-yl)pyridine-2-sulfonamide
SMILESCCNc1cccnc1S(=O)(=O)NC1CCCOC1
InChIInChI=1S/C12H19N3O3S/c1-2-13-11-6-3-7-14-12(11)19(16,17)15-10-5-4-8-18-9-10/h3,6-7,10,13,15H,2,4-5,8-9H2,1H3
InChIKeyRLQBPIYNTBHADF-UHFFFAOYSA-N
MW285.37 g/mol
LogP0.97
Rot. Bonds5

About 3-(ethylamino)-N-(oxan-3-yl)pyridine-2-sulfonamide

3-(ethylamino)-N-(oxan-3-yl)pyridine-2-sulfonamide (PubChem CID 103305993) has the molecular formula C12H19N3O3S and a molecular weight of 285.37 g/mol. Its IUPAC name is 3-(ethylamino)-N-(oxan-3-yl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-(ethylamino)-N-(oxan-3-yl)pyridine-2-sulfonamide
PubChem CID103305993
Molecular FormulaC12H19N3O3S
Molecular Weight285.37 g/mol
Exact Mass285.11
IUPAC Name3-(ethylamino)-N-(oxan-3-yl)pyridine-2-sulfonamide
SMILESCCNc1cccnc1S(=O)(=O)NC1CCCOC1
InChIInChI=1S/C12H19N3O3S/c1-2-13-11-6-3-7-14-12(11)19(16,17)15-10-5-4-8-18-9-10/h3,6-7,10,13,15H,2,4-5,8-9H2,1H3
InChIKeyRLQBPIYNTBHADF-UHFFFAOYSA-N
XLogP0.97
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-3-(ethylamino)pyridine-2-sulfonamide
CID 103303691
3-(ethylamino)-N-(thian-4-yl)pyridine-2-sulfonamide
CID 103307536
3-fluoro-N-(oxan-3-yl)pyridine-2-sulfonamide
CID 103300080
N-(1,1-dioxothiolan-3-yl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103303063
N-(1-cyclopropylpyrrolidin-3-yl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103305291
2-(methylamino)-N-(oxan-3-yl)pyridine-3-sulfonamide
CID 63361997
N-(3-methylcyclobutyl)-3-(propylamino)pyridine-2-sulfonamide
CID 103307276
N-cyclobutyl-3-(methylamino)pyridine-2-sulfonamide
CID 103305744
N-(2-cyclopentylethyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103304931
4-(ethylamino)-N-(oxolan-3-yl)pyridine-3-sulfonamide
CID 80714391
3-(oxan-3-ylsulfamoyl)pyridine-2-carbothioamide
CID 106597324
N-(oxan-3-yl)benzenesulfonamide
CID 63613851

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-N-(oxan-3-yl)pyridine-2-sulfonamide?
The IUPAC name of 3-(ethylamino)-N-(oxan-3-yl)pyridine-2-sulfonamide (CID 103305993) is 3-(ethylamino)-N-(oxan-3-yl)pyridine-2-sulfonamide.
What is the SMILES notation for 3-(ethylamino)-N-(oxan-3-yl)pyridine-2-sulfonamide?
The canonical SMILES for 3-(ethylamino)-N-(oxan-3-yl)pyridine-2-sulfonamide is CCNc1cccnc1S(=O)(=O)NC1CCCOC1.
What is the InChIKey of 3-(ethylamino)-N-(oxan-3-yl)pyridine-2-sulfonamide?
The InChIKey is RLQBPIYNTBHADF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3S/c1-2-13-11-6-3-7-14-12(11)19(16,17)15-10-5-4-8-18-9-10/h3,6-7,10,13,15H,2,4-5,8-9H2,1H3.
What are the key properties of 3-(ethylamino)-N-(oxan-3-yl)pyridine-2-sulfonamide?
3-(ethylamino)-N-(oxan-3-yl)pyridine-2-sulfonamide has a molecular weight of 285.37 g/mol, XLogP of 0.97, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-N-(oxan-3-yl)pyridine-2-sulfonamide is sourced from PubChem (CID 103305993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).