5-chloro-N-(oxan-4-yl)-6-oxo-1H-pyridine-3-sulfonamide

C10H13ClN2O4S — CID 64607304

IUPAC5-chloro-N-(oxan-4-yl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESO=c1[nH]cc(S(=O)(=O)NC2CCOCC2)cc1Cl
InChIInChI=1S/C10H13ClN2O4S/c11-9-5-8(6-12-10(9)14)18(15,16)13-7-1-3-17-4-2-7/h5-7,13H,1-4H2,(H,12,14)
InChIKeyULCONZLGXAPHIM-UHFFFAOYSA-N
MW292.74 g/mol
LogP0.49
Rot. Bonds3

About 5-chloro-N-(oxan-4-yl)-6-oxo-1H-pyridine-3-sulfonamide

5-chloro-N-(oxan-4-yl)-6-oxo-1H-pyridine-3-sulfonamide (PubChem CID 64607304) has the molecular formula C10H13ClN2O4S and a molecular weight of 292.74 g/mol. Its IUPAC name is 5-chloro-N-(oxan-4-yl)-6-oxo-1H-pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(oxan-4-yl)-6-oxo-1H-pyridine-3-sulfonamide
PubChem CID64607304
Molecular FormulaC10H13ClN2O4S
Molecular Weight292.74 g/mol
Exact Mass292.03
IUPAC Name5-chloro-N-(oxan-4-yl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESO=c1[nH]cc(S(=O)(=O)NC2CCOCC2)cc1Cl
InChIInChI=1S/C10H13ClN2O4S/c11-9-5-8(6-12-10(9)14)18(15,16)13-7-1-3-17-4-2-7/h5-7,13H,1-4H2,(H,12,14)
InChIKeyULCONZLGXAPHIM-UHFFFAOYSA-N
XLogP0.49
TPSA88.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.74
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dichloro-N-(oxan-4-yl)benzenesulfonamide
CID 110726881
5-(aminomethyl)-N-(oxan-4-yl)-1H-pyrrole-3-sulfonamide
CID 114135299
3-chloro-4-methyl-N-(oxan-4-yl)benzenesulfonamide
CID 110726898
5-chloro-N-[2-(hydroxymethyl)cyclopentyl]-6-oxo-1H-pyridine-3-sulfonamide
CID 106364163
5-chloro-N-[2-(hydroxymethyl)cyclohexyl]-6-oxo-1H-pyridine-3-sulfonamide
CID 106364168
5-chloro-N-(1,3-dimethylpiperidin-4-yl)-6-oxo-1H-pyridine-3-sulfonamide
CID 114505759
5-chloro-N-(1-cyclopropylpropan-2-yl)-6-oxo-1H-pyridine-3-sulfonamide
CID 64607914
5-chloro-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-6-oxo-1H-pyridine-3-sulfonamide
CID 64608472
2-chloro-N-(oxan-4-yl)benzenesulfonamide
CID 110726925
5-chloro-N-[(3-hydroxycyclopentyl)methyl]-6-oxo-1H-pyridine-3-sulfonamide
CID 106137444
5-chloro-N-(1-methylcyclobutyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 113485860
5-chloro-N-(2,6-difluorophenyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 64606342

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(oxan-4-yl)-6-oxo-1H-pyridine-3-sulfonamide?
The IUPAC name of 5-chloro-N-(oxan-4-yl)-6-oxo-1H-pyridine-3-sulfonamide (CID 64607304) is 5-chloro-N-(oxan-4-yl)-6-oxo-1H-pyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-N-(oxan-4-yl)-6-oxo-1H-pyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-N-(oxan-4-yl)-6-oxo-1H-pyridine-3-sulfonamide is O=c1[nH]cc(S(=O)(=O)NC2CCOCC2)cc1Cl.
What is the InChIKey of 5-chloro-N-(oxan-4-yl)-6-oxo-1H-pyridine-3-sulfonamide?
The InChIKey is ULCONZLGXAPHIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O4S/c11-9-5-8(6-12-10(9)14)18(15,16)13-7-1-3-17-4-2-7/h5-7,13H,1-4H2,(H,12,14).
What are the key properties of 5-chloro-N-(oxan-4-yl)-6-oxo-1H-pyridine-3-sulfonamide?
5-chloro-N-(oxan-4-yl)-6-oxo-1H-pyridine-3-sulfonamide has a molecular weight of 292.74 g/mol, XLogP of 0.49, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(oxan-4-yl)-6-oxo-1H-pyridine-3-sulfonamide is sourced from PubChem (CID 64607304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).