3,5-dichloro-N-(6-morpholin-4-yl-3-pyridinyl)benzenesulfonamide

C15H15Cl2N3O3S — CID 25044149

IUPAC3,5-dichloro-N-(6-morpholin-4-yl-3-pyridinyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(N2CCOCC2)nc1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H15Cl2N3O3S/c16-11-7-12(17)9-14(8-11)24(21,22)19-13-1-2-15(18-10-13)20-3-5-23-6-4-20/h1-2,7-10,19H,3-6H2
InChIKeyRNLODWYJPOEEQM-UHFFFAOYSA-N
MW388.28 g/mol
LogP3.03
Rot. Bonds4

About 3,5-dichloro-N-(6-morpholin-4-yl-3-pyridinyl)benzenesulfonamide

3,5-dichloro-N-(6-morpholin-4-yl-3-pyridinyl)benzenesulfonamide (PubChem CID 25044149) has the molecular formula C15H15Cl2N3O3S and a molecular weight of 388.28 g/mol. Its IUPAC name is 3,5-dichloro-N-(6-morpholin-4-yl-3-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name3,5-dichloro-N-(6-morpholin-4-yl-3-pyridinyl)benzenesulfonamide
PubChem CID25044149
Molecular FormulaC15H15Cl2N3O3S
Molecular Weight388.28 g/mol
Exact Mass387.02
IUPAC Name3,5-dichloro-N-(6-morpholin-4-yl-3-pyridinyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(N2CCOCC2)nc1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H15Cl2N3O3S/c16-11-7-12(17)9-14(8-11)24(21,22)19-13-1-2-15(18-10-13)20-3-5-23-6-4-20/h1-2,7-10,19H,3-6H2
InChIKeyRNLODWYJPOEEQM-UHFFFAOYSA-N
XLogP3.03
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.28
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3,5-dichloro-N-(4-morpholin-4-ylphenyl)benzenesulfonamide
CID 3856880
2,4-dichloro-5-methyl-N-(6-morpholin-4-yl-3-pyridinyl)benzenesulfonamide
CID 74225889
N-(6-morpholin-4-yl-3-pyridinyl)ethanesulfonamide
CID 53016560
3-chloro-N-[6-(4-ethylpiperazin-1-yl)-3-pyridinyl]benzenesulfonamide
CID 113011100
3,5-dichloro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide
CID 103775753
N-(6-amino-3-pyridinyl)-3,5-dichlorobenzenesulfonamide
CID 55025804
6-morpholin-4-yl-N-propan-2-ylpyridine-3-sulfonamide
CID 58525227
5-chloro-2-methoxy-N-(6-pyrrolidin-1-yl-3-pyridinyl)benzenesulfonamide
CID 113009843
4-(5-chloro-2-pyridinyl)-1,4-oxazepane
CID 66234346
4-fluoro-N-[6-(4-formylpiperazin-1-yl)-3-pyridinyl]benzenesulfonamide
CID 113011178
N-cyclopentyl-6-morpholin-4-ylpyridin-3-amine
CID 43724730
N-[6-(azepan-1-yl)-3-pyridinyl]-4-tert-butylbenzenesulfonamide
CID 113015975

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-(6-morpholin-4-yl-3-pyridinyl)benzenesulfonamide?
The IUPAC name of 3,5-dichloro-N-(6-morpholin-4-yl-3-pyridinyl)benzenesulfonamide (CID 25044149) is 3,5-dichloro-N-(6-morpholin-4-yl-3-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 3,5-dichloro-N-(6-morpholin-4-yl-3-pyridinyl)benzenesulfonamide?
The canonical SMILES for 3,5-dichloro-N-(6-morpholin-4-yl-3-pyridinyl)benzenesulfonamide is O=S(=O)(Nc1ccc(N2CCOCC2)nc1)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3,5-dichloro-N-(6-morpholin-4-yl-3-pyridinyl)benzenesulfonamide?
The InChIKey is RNLODWYJPOEEQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl2N3O3S/c16-11-7-12(17)9-14(8-11)24(21,22)19-13-1-2-15(18-10-13)20-3-5-23-6-4-20/h1-2,7-10,19H,3-6H2.
What are the key properties of 3,5-dichloro-N-(6-morpholin-4-yl-3-pyridinyl)benzenesulfonamide?
3,5-dichloro-N-(6-morpholin-4-yl-3-pyridinyl)benzenesulfonamide has a molecular weight of 388.28 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-(6-morpholin-4-yl-3-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 25044149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).