3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzenesulfonamide

C15H16ClN3O3S — CID 113025354

IUPAC3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(N2CCOCC2)cn1)c1cccc(Cl)c1
InChIInChI=1S/C15H16ClN3O3S/c16-12-2-1-3-14(10-12)23(20,21)18-15-5-4-13(11-17-15)19-6-8-22-9-7-19/h1-5,10-11H,6-9H2,(H,17,18)
InChIKeyACOSWGZTHSBDIH-UHFFFAOYSA-N
MW353.83 g/mol
LogP2.37
Rot. Bonds4

About 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzenesulfonamide

3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzenesulfonamide (PubChem CID 113025354) has the molecular formula C15H16ClN3O3S and a molecular weight of 353.83 g/mol. Its IUPAC name is 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzenesulfonamide
PubChem CID113025354
Molecular FormulaC15H16ClN3O3S
Molecular Weight353.83 g/mol
Exact Mass353.06
IUPAC Name3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(N2CCOCC2)cn1)c1cccc(Cl)c1
InChIInChI=1S/C15H16ClN3O3S/c16-12-2-1-3-14(10-12)23(20,21)18-15-5-4-13(11-17-15)19-6-8-22-9-7-19/h1-5,10-11H,6-9H2,(H,17,18)
InChIKeyACOSWGZTHSBDIH-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

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Related Compounds

3-chloro-N-(3-morpholin-4-ylphenyl)benzenesulfonamide
CID 55891569
5-chloro-N-(5-morpholin-4-yl-2-pyridinyl)thiophene-2-sulfonamide
CID 113025338
3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzamide
CID 38139828
6-[(3-chlorophenyl)sulfonylamino]pyridine-3-carboxylic acid
CID 61319004
3,5-dichloro-N-(4-morpholin-4-ylphenyl)benzenesulfonamide
CID 3856880
3,4-dimethyl-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzenesulfonamide
CID 113024384
N-(5-morpholin-4-yl-2-pyridinyl)-2-phenylethanesulfonamide
CID 113025343
4-fluoro-3-methyl-N-(5-piperidin-1-yl-2-pyridinyl)benzenesulfonamide
CID 113024649
3-chloro-2-methyl-N-(5-piperidin-1-yl-2-pyridinyl)benzenesulfonamide
CID 68842273
N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide
CID 113026209
6-chloro-N-(3-morpholin-4-ylphenyl)pyridine-3-sulfonamide
CID 110423235
N-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide
CID 110362791

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzenesulfonamide?
The IUPAC name of 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzenesulfonamide (CID 113025354) is 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzenesulfonamide?
The canonical SMILES for 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzenesulfonamide is O=S(=O)(Nc1ccc(N2CCOCC2)cn1)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzenesulfonamide?
The InChIKey is ACOSWGZTHSBDIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O3S/c16-12-2-1-3-14(10-12)23(20,21)18-15-5-4-13(11-17-15)19-6-8-22-9-7-19/h1-5,10-11H,6-9H2,(H,17,18).
What are the key properties of 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzenesulfonamide?
3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzenesulfonamide 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 3-chloro-N-(5-morpholin-4-yl-2-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 113025354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).