N-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide

C16H17ClN2O3S — CID 110362791

IUPACN-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1cc(N2CCOCC2)ccc1Cl)c1ccccc1
InChIInChI=1S/C16H17ClN2O3S/c17-15-7-6-13(19-8-10-22-11-9-19)12-16(15)18-23(20,21)14-4-2-1-3-5-14/h1-7,12,18H,8-11H2
InChIKeyRZNKHSIQHSSWOR-UHFFFAOYSA-N
MW352.84 g/mol
LogP2.98
Rot. Bonds4

About N-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide

N-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide (PubChem CID 110362791) has the molecular formula C16H17ClN2O3S and a molecular weight of 352.84 g/mol. Its IUPAC name is N-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide
PubChem CID110362791
Molecular FormulaC16H17ClN2O3S
Molecular Weight352.84 g/mol
Exact Mass352.06
IUPAC NameN-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1cc(N2CCOCC2)ccc1Cl)c1ccccc1
InChIInChI=1S/C16H17ClN2O3S/c17-15-7-6-13(19-8-10-22-11-9-19)12-16(15)18-23(20,21)14-4-2-1-3-5-14/h1-7,12,18H,8-11H2
InChIKeyRZNKHSIQHSSWOR-UHFFFAOYSA-N
XLogP2.98
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.84
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methyl-5-morpholin-4-ylphenyl)benzenesulfonamide
CID 110362516
2-(benzenesulfonamido)-5-morpholin-4-ylbenzoic acid
CID 45302820
N-(2-chloro-5-morpholin-4-ylphenyl)-4-methoxy-3-methylbenzenesulfonamide
CID 110362802
N-[2-chloro-5-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]benzenesulfonamide
CID 112505889
N-(2-chloro-5-morpholin-4-ylphenyl)-2-methoxy-5-methylbenzenesulfonamide
CID 110362804
3-chloro-N-(2-methoxy-5-morpholin-4-ylphenyl)-4-methylbenzenesulfonamide
CID 110359837
N-(2-methyl-5-piperidin-1-ylphenyl)benzenesulfonamide
CID 110362204
N-(2-chloro-5-pyrrolidin-1-ylphenyl)-1-phenylmethanesulfonamide
CID 110361957
N-[4-[(2-chloro-5-pyrrolidin-1-ylphenyl)sulfamoyl]phenyl]acetamide
CID 110361959
N-(2-chloro-5-pyrrolidin-1-ylphenyl)-1,3-benzodioxole-5-sulfonamide
CID 110361952
N-(5-bromo-2-chlorophenyl)benzenesulfonamide
CID 62909796
3-chloro-N-(3-morpholin-4-ylphenyl)benzenesulfonamide
CID 55891569

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide?
The IUPAC name of N-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide (CID 110362791) is N-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide.
What is the SMILES notation for N-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide?
The canonical SMILES for N-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide is O=S(=O)(Nc1cc(N2CCOCC2)ccc1Cl)c1ccccc1.
What is the InChIKey of N-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide?
The InChIKey is RZNKHSIQHSSWOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O3S/c17-15-7-6-13(19-8-10-22-11-9-19)12-16(15)18-23(20,21)14-4-2-1-3-5-14/h1-7,12,18H,8-11H2.
What are the key properties of N-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide?
N-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide has a molecular weight of 352.84 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide is sourced from PubChem (CID 110362791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).