4-cyclohexyl-N-piperidin-4-ylbenzenesulfonamide;hydrochloride

C17H27ClN2O2S — CID 119960370

IUPAC4-cyclohexyl-N-piperidin-4-ylbenzenesulfonamide;hydrochloride
SMILESCl.O=S(=O)(NC1CCNCC1)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C17H26N2O2S.ClH/c20-22(21,19-16-10-12-18-13-11-16)17-8-6-15(7-9-17)14-4-2-1-3-5-14;/h6-9,14,16,18-19H,1-5,10-13H2;1H
InChIKeyHIDLXHXCKALFED-UHFFFAOYSA-N
MW358.94 g/mol
LogP3.19
Rot. Bonds4

About 4-cyclohexyl-N-piperidin-4-ylbenzenesulfonamide;hydrochloride

4-cyclohexyl-N-piperidin-4-ylbenzenesulfonamide;hydrochloride (PubChem CID 119960370) has the molecular formula C17H27ClN2O2S and a molecular weight of 358.94 g/mol. Its IUPAC name is 4-cyclohexyl-N-piperidin-4-ylbenzenesulfonamide;hydrochloride.

Molecular Properties

Compound Name4-cyclohexyl-N-piperidin-4-ylbenzenesulfonamide;hydrochloride
PubChem CID119960370
Molecular FormulaC17H27ClN2O2S
Molecular Weight358.94 g/mol
Exact Mass358.15
IUPAC Name4-cyclohexyl-N-piperidin-4-ylbenzenesulfonamide;hydrochloride
SMILESCl.O=S(=O)(NC1CCNCC1)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C17H26N2O2S.ClH/c20-22(21,19-16-10-12-18-13-11-16)17-8-6-15(7-9-17)14-4-2-1-3-5-14;/h6-9,14,16,18-19H,1-5,10-13H2;1H
InChIKeyHIDLXHXCKALFED-UHFFFAOYSA-N
XLogP3.19
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.94
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-cyclohexyl-N-pyrrolidin-3-ylbenzenesulfonamide;hydrochloride
CID 119966752
4-cyclohexyl-N-[(3S)-piperidin-3-yl]benzenesulfonamide
CID 120716650
1-N-methyl-4-N-piperidin-4-ylbenzene-1,4-disulfonamide;hydrochloride
CID 120998885
N-cyclohexyl-4-[(3S)-5-oxopyrrolidin-3-yl]benzenesulfonamide
CID 714404
N-cyclohexyl-4-(5-oxopyrrolidin-3-yl)benzenesulfonamide
CID 3934633
3-[4-[(4-piperidin-4-ylphenyl)sulfonylamino]cyclohexyl]propanoic acid
CID 67844676
3-[4-(piperidin-4-ylsulfamoyl)phenyl]prop-2-enoic acid
CID 76899841
N-piperidin-4-yl-4-(2,2,2-trifluoroethyl)benzenesulfonamide;hydrochloride
CID 120706275
4-[(dimethylamino)methyl]-N-piperidin-4-ylbenzenesulfonamide;hydrochloride
CID 120874458
4-cyclohexyl-N-[[4-(cyclopropylsulfamoyl)phenyl]methyl]benzamide
CID 52685874
N-piperidin-4-yl-4-propylbenzenesulfonamide
CID 43603347
3,4-dichloro-N-piperidin-4-ylbenzenesulfonamide
CID 28810999

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-N-piperidin-4-ylbenzenesulfonamide;hydrochloride?
The IUPAC name of 4-cyclohexyl-N-piperidin-4-ylbenzenesulfonamide;hydrochloride (CID 119960370) is 4-cyclohexyl-N-piperidin-4-ylbenzenesulfonamide;hydrochloride.
What is the SMILES notation for 4-cyclohexyl-N-piperidin-4-ylbenzenesulfonamide;hydrochloride?
The canonical SMILES for 4-cyclohexyl-N-piperidin-4-ylbenzenesulfonamide;hydrochloride is Cl.O=S(=O)(NC1CCNCC1)c1ccc(C2CCCCC2)cc1.
What is the InChIKey of 4-cyclohexyl-N-piperidin-4-ylbenzenesulfonamide;hydrochloride?
The InChIKey is HIDLXHXCKALFED-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2S.ClH/c20-22(21,19-16-10-12-18-13-11-16)17-8-6-15(7-9-17)14-4-2-1-3-5-14;/h6-9,14,16,18-19H,1-5,10-13H2;1H.
What are the key properties of 4-cyclohexyl-N-piperidin-4-ylbenzenesulfonamide;hydrochloride?
4-cyclohexyl-N-piperidin-4-ylbenzenesulfonamide;hydrochloride has a molecular weight of 358.94 g/mol, XLogP of 3.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-N-piperidin-4-ylbenzenesulfonamide;hydrochloride is sourced from PubChem (CID 119960370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).