2,6-dichloro-N-(4-methyl-2-morpholin-4-ylpentyl)benzenesulfonamide

C16H24Cl2N2O3S — CID 46540574

IUPAC2,6-dichloro-N-(4-methyl-2-morpholin-4-ylpentyl)benzenesulfonamide
SMILESCC(C)CC(CNS(=O)(=O)c1c(Cl)cccc1Cl)N1CCOCC1
InChIInChI=1S/C16H24Cl2N2O3S/c1-12(2)10-13(20-6-8-23-9-7-20)11-19-24(21,22)16-14(17)4-3-5-15(16)18/h3-5,12-13,19H,6-11H2,1-2H3
InChIKeyVKIHWRCSCOWQLD-UHFFFAOYSA-N
MW395.35 g/mol
LogP3.02
Rot. Bonds7

About 2,6-dichloro-N-(4-methyl-2-morpholin-4-ylpentyl)benzenesulfonamide

2,6-dichloro-N-(4-methyl-2-morpholin-4-ylpentyl)benzenesulfonamide (PubChem CID 46540574) has the molecular formula C16H24Cl2N2O3S and a molecular weight of 395.35 g/mol. Its IUPAC name is 2,6-dichloro-N-(4-methyl-2-morpholin-4-ylpentyl)benzenesulfonamide.

Molecular Properties

Compound Name2,6-dichloro-N-(4-methyl-2-morpholin-4-ylpentyl)benzenesulfonamide
PubChem CID46540574
Molecular FormulaC16H24Cl2N2O3S
Molecular Weight395.35 g/mol
Exact Mass394.09
IUPAC Name2,6-dichloro-N-(4-methyl-2-morpholin-4-ylpentyl)benzenesulfonamide
SMILESCC(C)CC(CNS(=O)(=O)c1c(Cl)cccc1Cl)N1CCOCC1
InChIInChI=1S/C16H24Cl2N2O3S/c1-12(2)10-13(20-6-8-23-9-7-20)11-19-24(21,22)16-14(17)4-3-5-15(16)18/h3-5,12-13,19H,6-11H2,1-2H3
InChIKeyVKIHWRCSCOWQLD-UHFFFAOYSA-N
XLogP3.02
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.35
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dichloro-N-(4-methyl-2-morpholin-4-ylpentyl)benzenesulfonamide
CID 110403316
N-[4-[(4-methyl-2-morpholin-4-ylpentyl)sulfamoyl]phenyl]acetamide
CID 110403337
N-(4-methyl-2-morpholin-4-ylpentyl)piperidine-1-sulfonamide
CID 134017896
N-(4-methyl-2-pyrrolidin-1-ylpentyl)benzenesulfonamide
CID 110403541
2-(2-chloro-6-fluorophenyl)-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide
CID 46540918
3-chloro-N-[4-methyl-2-(4-methylpiperazin-1-yl)pentyl]benzenesulfonamide
CID 110403737
4-chloro-N-[4-methyl-2-(4-methylpiperazin-1-yl)pentyl]benzenesulfonamide
CID 110403691
2,6-dichloro-N-[2-(diethylamino)propyl]benzenesulfonamide
CID 46457714
N-(4-methyl-2-morpholin-4-ylpentyl)-4-(phenylsulfamoyl)benzamide
CID 43044286
3-chloro-N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]benzenesulfonamide
CID 32683344
2,3-dichloro-N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]benzenesulfonamide
CID 43064501
N-(2-morpholin-4-yl-3-phenylpropyl)benzenesulfonamide
CID 110403847

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-(4-methyl-2-morpholin-4-ylpentyl)benzenesulfonamide?
The IUPAC name of 2,6-dichloro-N-(4-methyl-2-morpholin-4-ylpentyl)benzenesulfonamide (CID 46540574) is 2,6-dichloro-N-(4-methyl-2-morpholin-4-ylpentyl)benzenesulfonamide.
What is the SMILES notation for 2,6-dichloro-N-(4-methyl-2-morpholin-4-ylpentyl)benzenesulfonamide?
The canonical SMILES for 2,6-dichloro-N-(4-methyl-2-morpholin-4-ylpentyl)benzenesulfonamide is CC(C)CC(CNS(=O)(=O)c1c(Cl)cccc1Cl)N1CCOCC1.
What is the InChIKey of 2,6-dichloro-N-(4-methyl-2-morpholin-4-ylpentyl)benzenesulfonamide?
The InChIKey is VKIHWRCSCOWQLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24Cl2N2O3S/c1-12(2)10-13(20-6-8-23-9-7-20)11-19-24(21,22)16-14(17)4-3-5-15(16)18/h3-5,12-13,19H,6-11H2,1-2H3.
What are the key properties of 2,6-dichloro-N-(4-methyl-2-morpholin-4-ylpentyl)benzenesulfonamide?
2,6-dichloro-N-(4-methyl-2-morpholin-4-ylpentyl)benzenesulfonamide has a molecular weight of 395.35 g/mol, XLogP of 3.02, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-(4-methyl-2-morpholin-4-ylpentyl)benzenesulfonamide is sourced from PubChem (CID 46540574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).