6-chloro-N-(3-morpholin-4-ylphenyl)pyridine-3-sulfonamide

C15H16ClN3O3S — CID 110423235

IUPAC6-chloro-N-(3-morpholin-4-ylphenyl)pyridine-3-sulfonamide
SMILESO=S(=O)(Nc1cccc(N2CCOCC2)c1)c1ccc(Cl)nc1
InChIInChI=1S/C15H16ClN3O3S/c16-15-5-4-14(11-17-15)23(20,21)18-12-2-1-3-13(10-12)19-6-8-22-9-7-19/h1-5,10-11,18H,6-9H2
InChIKeyVMHWIKCAJJLALB-UHFFFAOYSA-N
MW353.83 g/mol
LogP2.37
Rot. Bonds4

About 6-chloro-N-(3-morpholin-4-ylphenyl)pyridine-3-sulfonamide

6-chloro-N-(3-morpholin-4-ylphenyl)pyridine-3-sulfonamide (PubChem CID 110423235) has the molecular formula C15H16ClN3O3S and a molecular weight of 353.83 g/mol. Its IUPAC name is 6-chloro-N-(3-morpholin-4-ylphenyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-chloro-N-(3-morpholin-4-ylphenyl)pyridine-3-sulfonamide
PubChem CID110423235
Molecular FormulaC15H16ClN3O3S
Molecular Weight353.83 g/mol
Exact Mass353.06
IUPAC Name6-chloro-N-(3-morpholin-4-ylphenyl)pyridine-3-sulfonamide
SMILESO=S(=O)(Nc1cccc(N2CCOCC2)c1)c1ccc(Cl)nc1
InChIInChI=1S/C15H16ClN3O3S/c16-15-5-4-14(11-17-15)23(20,21)18-12-2-1-3-13(10-12)19-6-8-22-9-7-19/h1-5,10-11,18H,6-9H2
InChIKeyVMHWIKCAJJLALB-UHFFFAOYSA-N
XLogP2.37
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.83
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_H(6)', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

3-chloro-N-(3-morpholin-4-ylphenyl)benzenesulfonamide
CID 55891569
3-chloro-4-fluoro-N-(3-morpholin-4-ylphenyl)benzenesulfonamide
CID 55891189
3-[(6-chloro-3-pyridinyl)sulfonylamino]benzoic acid
CID 7938689
4-methoxy-3-methyl-N-(3-morpholin-4-ylphenyl)benzenesulfonamide
CID 110362395
6-chloro-N-phenylpyridine-3-sulfonamide
CID 4729892
6-chloro-N-morpholin-4-ylpyridine-3-sulfonamide
CID 83014235
6-chloro-N-[[3-(morpholin-4-ylmethyl)phenyl]methyl]pyridine-3-sulfonamide
CID 55872974
6-chloro-N-(3-ethynylphenyl)pyridine-3-sulfonamide
CID 24689721
N-(3-pyrrolidin-1-ylphenyl)pyridine-3-sulfonamide
CID 75370822
[3-[(6-chloro-3-pyridinyl)sulfonylamino]phenyl]urea
CID 36510490
N-(3-pyrrolidin-1-ylphenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 110361647
3,5-dichloro-N-(4-morpholin-4-ylphenyl)benzenesulfonamide
CID 3856880

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(3-morpholin-4-ylphenyl)pyridine-3-sulfonamide?
The IUPAC name of 6-chloro-N-(3-morpholin-4-ylphenyl)pyridine-3-sulfonamide (CID 110423235) is 6-chloro-N-(3-morpholin-4-ylphenyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-chloro-N-(3-morpholin-4-ylphenyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-chloro-N-(3-morpholin-4-ylphenyl)pyridine-3-sulfonamide is O=S(=O)(Nc1cccc(N2CCOCC2)c1)c1ccc(Cl)nc1.
What is the InChIKey of 6-chloro-N-(3-morpholin-4-ylphenyl)pyridine-3-sulfonamide?
The InChIKey is VMHWIKCAJJLALB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O3S/c16-15-5-4-14(11-17-15)23(20,21)18-12-2-1-3-13(10-12)19-6-8-22-9-7-19/h1-5,10-11,18H,6-9H2.
What are the key properties of 6-chloro-N-(3-morpholin-4-ylphenyl)pyridine-3-sulfonamide?
6-chloro-N-(3-morpholin-4-ylphenyl)pyridine-3-sulfonamide has a molecular weight of 353.83 g/mol, XLogP of 2.37, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(3-morpholin-4-ylphenyl)pyridine-3-sulfonamide is sourced from PubChem (CID 110423235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).