N-phenylpiperidine-3-sulfonamide;hydrochloride

C11H17ClN2O2S — CID 122164272

IUPACN-phenylpiperidine-3-sulfonamide;hydrochloride
SMILESCl.O=S(=O)(Nc1ccccc1)C1CCCNC1
InChIInChI=1S/C11H16N2O2S.ClH/c14-16(15,11-7-4-8-12-9-11)13-10-5-2-1-3-6-10;/h1-3,5-6,11-13H,4,7-9H2;1H
InChIKeyJKFUYNVANZSOHC-UHFFFAOYSA-N
MW276.79 g/mol
LogP1.60
Rot. Bonds3

About N-phenylpiperidine-3-sulfonamide;hydrochloride

N-phenylpiperidine-3-sulfonamide;hydrochloride (PubChem CID 122164272) has the molecular formula C11H17ClN2O2S and a molecular weight of 276.79 g/mol. Its IUPAC name is N-phenylpiperidine-3-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN-phenylpiperidine-3-sulfonamide;hydrochloride
PubChem CID122164272
Molecular FormulaC11H17ClN2O2S
Molecular Weight276.79 g/mol
Exact Mass276.07
IUPAC NameN-phenylpiperidine-3-sulfonamide;hydrochloride
SMILESCl.O=S(=O)(Nc1ccccc1)C1CCCNC1
InChIInChI=1S/C11H16N2O2S.ClH/c14-16(15,11-7-4-8-12-9-11)13-10-5-2-1-3-6-10;/h1-3,5-6,11-13H,4,7-9H2;1H
InChIKeyJKFUYNVANZSOHC-UHFFFAOYSA-N
XLogP1.60
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.79
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-phenylpiperidine-3-sulfonamide;hydrochloride?
The IUPAC name of N-phenylpiperidine-3-sulfonamide;hydrochloride (CID 122164272) is N-phenylpiperidine-3-sulfonamide;hydrochloride.
What is the SMILES notation for N-phenylpiperidine-3-sulfonamide;hydrochloride?
The canonical SMILES for N-phenylpiperidine-3-sulfonamide;hydrochloride is Cl.O=S(=O)(Nc1ccccc1)C1CCCNC1.
What is the InChIKey of N-phenylpiperidine-3-sulfonamide;hydrochloride?
The InChIKey is JKFUYNVANZSOHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2S.ClH/c14-16(15,11-7-4-8-12-9-11)13-10-5-2-1-3-6-10;/h1-3,5-6,11-13H,4,7-9H2;1H.
What are the key properties of N-phenylpiperidine-3-sulfonamide;hydrochloride?
N-phenylpiperidine-3-sulfonamide;hydrochloride has a molecular weight of 276.79 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenylpiperidine-3-sulfonamide;hydrochloride is sourced from PubChem (CID 122164272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).