2-methoxy-N-piperidin-4-ylbenzenesulfonamide

C12H18N2O3S — CID 43603348

IUPAC2-methoxy-N-piperidin-4-ylbenzenesulfonamide
SMILESCOc1ccccc1S(=O)(=O)NC1CCNCC1
InChIInChI=1S/C12H18N2O3S/c1-17-11-4-2-3-5-12(11)18(15,16)14-10-6-8-13-9-7-10/h2-5,10,13-14H,6-9H2,1H3
InChIKeyZYIHGEALRCHERT-UHFFFAOYSA-N
MW270.35 g/mol
LogP0.73
Rot. Bonds4

About 2-methoxy-N-piperidin-4-ylbenzenesulfonamide

2-methoxy-N-piperidin-4-ylbenzenesulfonamide (PubChem CID 43603348) has the molecular formula C12H18N2O3S and a molecular weight of 270.35 g/mol. Its IUPAC name is 2-methoxy-N-piperidin-4-ylbenzenesulfonamide.

Molecular Properties

Compound Name2-methoxy-N-piperidin-4-ylbenzenesulfonamide
PubChem CID43603348
Molecular FormulaC12H18N2O3S
Molecular Weight270.35 g/mol
Exact Mass270.10
IUPAC Name2-methoxy-N-piperidin-4-ylbenzenesulfonamide
SMILESCOc1ccccc1S(=O)(=O)NC1CCNCC1
InChIInChI=1S/C12H18N2O3S/c1-17-11-4-2-3-5-12(11)18(15,16)14-10-6-8-13-9-7-10/h2-5,10,13-14H,6-9H2,1H3
InChIKeyZYIHGEALRCHERT-UHFFFAOYSA-N
XLogP0.73
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-azaspiro[3.5]nonan-8-yl)-2-methoxybenzenesulfonamide
CID 43597956
methyl 3-methoxy-4-(piperidin-4-ylsulfamoyl)benzoate
CID 120706280
2-chloro-N-piperidin-4-ylbenzenesulfonamide
CID 28811083
2-iodo-N-piperidin-4-ylbenzenesulfonamide;hydrochloride
CID 165111784
2-chloro-N-piperidin-4-ylbenzenesulfonamide;hydrochloride
CID 119960748
N-(1-benzylpiperidin-4-yl)-2-methoxybenzenesulfonamide
CID 51169998
2,5-dimethoxy-N-[(3S)-pyrrolidin-3-yl]benzenesulfonamide
CID 79686260
2-methoxy-N-(pyrrolidin-3-ylmethyl)benzenesulfonamide;hydrochloride
CID 120720923
3-(cyclopentylsulfamoyl)-4-methoxy-N-pyrrolidin-3-ylbenzamide
CID 119450739
2-chloro-5-methoxy-N-piperidin-4-ylbenzenesulfonamide;hydrochloride
CID 119960534
3-fluoro-4-methoxy-N-piperidin-4-ylbenzenesulfonamide;hydrochloride
CID 119960633
2-methoxy-N-piperidin-4-ylbenzamide
CID 16780894

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-piperidin-4-ylbenzenesulfonamide?
The IUPAC name of 2-methoxy-N-piperidin-4-ylbenzenesulfonamide (CID 43603348) is 2-methoxy-N-piperidin-4-ylbenzenesulfonamide.
What is the SMILES notation for 2-methoxy-N-piperidin-4-ylbenzenesulfonamide?
The canonical SMILES for 2-methoxy-N-piperidin-4-ylbenzenesulfonamide is COc1ccccc1S(=O)(=O)NC1CCNCC1.
What is the InChIKey of 2-methoxy-N-piperidin-4-ylbenzenesulfonamide?
The InChIKey is ZYIHGEALRCHERT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3S/c1-17-11-4-2-3-5-12(11)18(15,16)14-10-6-8-13-9-7-10/h2-5,10,13-14H,6-9H2,1H3.
What are the key properties of 2-methoxy-N-piperidin-4-ylbenzenesulfonamide?
2-methoxy-N-piperidin-4-ylbenzenesulfonamide has a molecular weight of 270.35 g/mol, XLogP of 0.73, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-piperidin-4-ylbenzenesulfonamide is sourced from PubChem (CID 43603348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).