4-(ethylamino)-N-(oxolan-3-yl)pyridine-3-sulfonamide

C11H17N3O3S — CID 80714391

IUPAC4-(ethylamino)-N-(oxolan-3-yl)pyridine-3-sulfonamide
SMILESCCNc1ccncc1S(=O)(=O)NC1CCOC1
InChIInChI=1S/C11H17N3O3S/c1-2-13-10-3-5-12-7-11(10)18(15,16)14-9-4-6-17-8-9/h3,5,7,9,14H,2,4,6,8H2,1H3,(H,12,13)
InChIKeyVVJMACPBAIEMMF-UHFFFAOYSA-N
MW271.34 g/mol
LogP0.58
Rot. Bonds5

About 4-(ethylamino)-N-(oxolan-3-yl)pyridine-3-sulfonamide

4-(ethylamino)-N-(oxolan-3-yl)pyridine-3-sulfonamide (PubChem CID 80714391) has the molecular formula C11H17N3O3S and a molecular weight of 271.34 g/mol. Its IUPAC name is 4-(ethylamino)-N-(oxolan-3-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name4-(ethylamino)-N-(oxolan-3-yl)pyridine-3-sulfonamide
PubChem CID80714391
Molecular FormulaC11H17N3O3S
Molecular Weight271.34 g/mol
Exact Mass271.10
IUPAC Name4-(ethylamino)-N-(oxolan-3-yl)pyridine-3-sulfonamide
SMILESCCNc1ccncc1S(=O)(=O)NC1CCOC1
InChIInChI=1S/C11H17N3O3S/c1-2-13-10-3-5-12-7-11(10)18(15,16)14-9-4-6-17-8-9/h3,5,7,9,14H,2,4,6,8H2,1H3,(H,12,13)
InChIKeyVVJMACPBAIEMMF-UHFFFAOYSA-N
XLogP0.58
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-(ethylamino)-N-(oxan-3-yl)pyridine-2-sulfonamide
CID 103305993
4-(ethylamino)-N-(thiolan-2-ylmethyl)pyridine-3-sulfonamide
CID 80586298
4-ethyl-N-(oxolan-3-yl)benzenesulfonamide
CID 110868831
3-amino-2,4-difluoro-N-(oxolan-3-yl)benzenesulfonamide
CID 107343713
4-N-(oxolan-3-yl)pyridine-3,4-diamine
CID 80717720
4-hydrazinyl-N-[2-(oxolan-3-yl)ethyl]pyridine-3-sulfonamide
CID 114130695
2-bromo-4-fluoro-N-(oxolan-3-yl)benzenesulfonamide
CID 80713106
4-(ethylamino)-N-[3-(methanesulfonamido)propyl]pyridine-3-sulfonamide
CID 106342226
2-fluoro-4-(methylaminomethyl)-N-(oxolan-3-yl)benzenesulfonamide
CID 106072492
2-fluoro-N-(oxolan-3-yl)-4-(propylaminomethyl)benzenesulfonamide
CID 106072319
5-chloro-3-(ethylaminomethyl)-2-fluoro-N-(oxolan-3-yl)benzenesulfonamide
CID 106072508
3-(ethylaminomethyl)-4-fluoro-N-(oxolan-3-yl)benzenesulfonamide
CID 106072571

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-N-(oxolan-3-yl)pyridine-3-sulfonamide?
The IUPAC name of 4-(ethylamino)-N-(oxolan-3-yl)pyridine-3-sulfonamide (CID 80714391) is 4-(ethylamino)-N-(oxolan-3-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 4-(ethylamino)-N-(oxolan-3-yl)pyridine-3-sulfonamide?
The canonical SMILES for 4-(ethylamino)-N-(oxolan-3-yl)pyridine-3-sulfonamide is CCNc1ccncc1S(=O)(=O)NC1CCOC1.
What is the InChIKey of 4-(ethylamino)-N-(oxolan-3-yl)pyridine-3-sulfonamide?
The InChIKey is VVJMACPBAIEMMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3S/c1-2-13-10-3-5-12-7-11(10)18(15,16)14-9-4-6-17-8-9/h3,5,7,9,14H,2,4,6,8H2,1H3,(H,12,13).
What are the key properties of 4-(ethylamino)-N-(oxolan-3-yl)pyridine-3-sulfonamide?
4-(ethylamino)-N-(oxolan-3-yl)pyridine-3-sulfonamide has a molecular weight of 271.34 g/mol, XLogP of 0.58, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-N-(oxolan-3-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 80714391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).