4-[[6-(4-chlorophenoxy)-3-pyridinyl]sulfonyl]morpholine

C15H15ClN2O4S — CID 24981897

IUPAC4-[[6-(4-chlorophenoxy)-3-pyridinyl]sulfonyl]morpholine
SMILESO=S(=O)(c1ccc(Oc2ccc(Cl)cc2)nc1)N1CCOCC1
InChIInChI=1S/C15H15ClN2O4S/c16-12-1-3-13(4-2-12)22-15-6-5-14(11-17-15)23(19,20)18-7-9-21-10-8-18/h1-6,11H,7-10H2
InChIKeyJVGUFPABNKTHDE-UHFFFAOYSA-N
MW354.82 g/mol
LogP2.55
Rot. Bonds4

About 4-[[6-(4-chlorophenoxy)-3-pyridinyl]sulfonyl]morpholine

4-[[6-(4-chlorophenoxy)-3-pyridinyl]sulfonyl]morpholine (PubChem CID 24981897) has the molecular formula C15H15ClN2O4S and a molecular weight of 354.82 g/mol. Its IUPAC name is 4-[[6-(4-chlorophenoxy)-3-pyridinyl]sulfonyl]morpholine.

Molecular Properties

Compound Name4-[[6-(4-chlorophenoxy)-3-pyridinyl]sulfonyl]morpholine
PubChem CID24981897
Molecular FormulaC15H15ClN2O4S
Molecular Weight354.82 g/mol
Exact Mass354.04
IUPAC Name4-[[6-(4-chlorophenoxy)-3-pyridinyl]sulfonyl]morpholine
SMILESO=S(=O)(c1ccc(Oc2ccc(Cl)cc2)nc1)N1CCOCC1
InChIInChI=1S/C15H15ClN2O4S/c16-12-1-3-13(4-2-12)22-15-6-5-14(11-17-15)23(19,20)18-7-9-21-10-8-18/h1-6,11H,7-10H2
InChIKeyJVGUFPABNKTHDE-UHFFFAOYSA-N
XLogP2.55
TPSA68.73 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.82
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-(3-Chlorophenoxy)-3-pyridinesulfonamide
CID 901268
5-chloro-2-ethoxy-N-(2-pyridinylmethyl)benzenesulfonamide
CID 1106588
Pyridine, 2-(3,4-dichlorophenoxy)-5-(methylsulfonyl)-
CID 514892
5-chloro-2-ethoxy-N-(pyridin-3-yl)benzene-1-sulfonamide
CID 9267841
1-[[6-(3-Chloro-4-fluorophenoxy)-3-pyridinyl]sulfonyl]-4-methylpiperazine
CID 2539884
2-[2-(4-Chlorophenoxy)ethylsulfanyl]-5-pyrrolidin-1-ylsulfonylpyridine
CID 7779721
6-[4-[2-(4-Chlorophenoxy)ethyl]piperazin-1-yl]pyridine-3-sulfonamide
CID 9203843
1-[[6-[2-(4-Chlorophenoxy)ethylsulfanyl]-3-pyridinyl]sulfonyl]-4-methylpiperazine
CID 16304684
4-[[6-(4-Nitrophenoxy)-3-pyridinyl]sulfonyl]morpholine
CID 18199951
1-Methyl-4-[[6-(4-propoxyphenoxy)-3-pyridinyl]sulfonyl]piperazine
CID 24982380
4-[3-[4-[(E)-2-(3-chloro-2-pyridinyl)ethenyl]sulfonylphenoxy]propyl]morpholine;hydrochloride
CID 155536526
2-(3,4-Dichlorophenoxy)-5-(methylsulfinyl)pyridine
CID 514891

Frequently Asked Questions

What is the IUPAC name of 4-[[6-(4-chlorophenoxy)-3-pyridinyl]sulfonyl]morpholine?
The IUPAC name of 4-[[6-(4-chlorophenoxy)-3-pyridinyl]sulfonyl]morpholine (CID 24981897) is 4-[[6-(4-chlorophenoxy)-3-pyridinyl]sulfonyl]morpholine.
What is the SMILES notation for 4-[[6-(4-chlorophenoxy)-3-pyridinyl]sulfonyl]morpholine?
The canonical SMILES for 4-[[6-(4-chlorophenoxy)-3-pyridinyl]sulfonyl]morpholine is O=S(=O)(c1ccc(Oc2ccc(Cl)cc2)nc1)N1CCOCC1.
What is the InChIKey of 4-[[6-(4-chlorophenoxy)-3-pyridinyl]sulfonyl]morpholine?
The InChIKey is JVGUFPABNKTHDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O4S/c16-12-1-3-13(4-2-12)22-15-6-5-14(11-17-15)23(19,20)18-7-9-21-10-8-18/h1-6,11H,7-10H2.
What are the key properties of 4-[[6-(4-chlorophenoxy)-3-pyridinyl]sulfonyl]morpholine?
4-[[6-(4-chlorophenoxy)-3-pyridinyl]sulfonyl]morpholine has a molecular weight of 354.82 g/mol, XLogP of 2.55, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[6-(4-chlorophenoxy)-3-pyridinyl]sulfonyl]morpholine is sourced from PubChem (CID 24981897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).