2-chloro-N-piperidin-4-ylbenzenesulfonamide

C11H15ClN2O2S — CID 28811083

IUPAC2-chloro-N-piperidin-4-ylbenzenesulfonamide
SMILESO=S(=O)(NC1CCNCC1)c1ccccc1Cl
InChIInChI=1S/C11H15ClN2O2S/c12-10-3-1-2-4-11(10)17(15,16)14-9-5-7-13-8-6-9/h1-4,9,13-14H,5-8H2
InChIKeyUCBXFLJLZWVCCP-UHFFFAOYSA-N
MW274.77 g/mol
LogP1.37
Rot. Bonds3

About 2-chloro-N-piperidin-4-ylbenzenesulfonamide

2-chloro-N-piperidin-4-ylbenzenesulfonamide (PubChem CID 28811083) has the molecular formula C11H15ClN2O2S and a molecular weight of 274.77 g/mol. Its IUPAC name is 2-chloro-N-piperidin-4-ylbenzenesulfonamide.

Molecular Properties

Compound Name2-chloro-N-piperidin-4-ylbenzenesulfonamide
PubChem CID28811083
Molecular FormulaC11H15ClN2O2S
Molecular Weight274.77 g/mol
Exact Mass274.05
IUPAC Name2-chloro-N-piperidin-4-ylbenzenesulfonamide
SMILESO=S(=O)(NC1CCNCC1)c1ccccc1Cl
InChIInChI=1S/C11H15ClN2O2S/c12-10-3-1-2-4-11(10)17(15,16)14-9-5-7-13-8-6-9/h1-4,9,13-14H,5-8H2
InChIKeyUCBXFLJLZWVCCP-UHFFFAOYSA-N
XLogP1.37
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.77
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-piperidin-4-ylbenzenesulfonamide;hydrochloride
CID 119960748
2-chloro-N-pyrrolidin-3-ylbenzenesulfonamide;hydrochloride
CID 119967181
4-chloro-N-piperidin-4-ylnaphthalene-1-sulfonamide;hydrochloride
CID 119960548
2,6-dichloro-N-piperidin-4-ylbenzenesulfonamide;hydrochloride
CID 119960503
2-chloro-N-(oxan-4-yl)benzenesulfonamide
CID 110726925
2,3-dichloro-N-[(3S)-pyrrolidin-3-yl]benzenesulfonamide
CID 79684857
2-iodo-N-piperidin-4-ylbenzenesulfonamide;hydrochloride
CID 165111784
2-chloro-5-fluoro-N-piperidin-4-ylbenzenesulfonamide
CID 115752112
5-bromo-2-chloro-N-piperidin-4-ylbenzenesulfonamide
CID 119960783
2-methoxy-N-piperidin-4-ylbenzenesulfonamide
CID 43603348
2-chloro-5-methoxy-N-piperidin-4-ylbenzenesulfonamide;hydrochloride
CID 119960534
5-bromo-2,4-dichloro-N-piperidin-4-ylbenzenesulfonamide
CID 120706363

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-piperidin-4-ylbenzenesulfonamide?
The IUPAC name of 2-chloro-N-piperidin-4-ylbenzenesulfonamide (CID 28811083) is 2-chloro-N-piperidin-4-ylbenzenesulfonamide.
What is the SMILES notation for 2-chloro-N-piperidin-4-ylbenzenesulfonamide?
The canonical SMILES for 2-chloro-N-piperidin-4-ylbenzenesulfonamide is O=S(=O)(NC1CCNCC1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-piperidin-4-ylbenzenesulfonamide?
The InChIKey is UCBXFLJLZWVCCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O2S/c12-10-3-1-2-4-11(10)17(15,16)14-9-5-7-13-8-6-9/h1-4,9,13-14H,5-8H2.
What are the key properties of 2-chloro-N-piperidin-4-ylbenzenesulfonamide?
2-chloro-N-piperidin-4-ylbenzenesulfonamide has a molecular weight of 274.77 g/mol, XLogP of 1.37, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-piperidin-4-ylbenzenesulfonamide is sourced from PubChem (CID 28811083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).