N-(2-piperidin-1-ylcyclohexyl)benzenesulfonamide

C17H26N2O2S — CID 2912766

IUPACN-(2-piperidin-1-ylcyclohexyl)benzenesulfonamide
SMILESO=S(=O)(NC1CCCCC1N1CCCCC1)c1ccccc1
InChIInChI=1S/C17H26N2O2S/c20-22(21,15-9-3-1-4-10-15)18-16-11-5-6-12-17(16)19-13-7-2-8-14-19/h1,3-4,9-10,16-18H,2,5-8,11-14H2
InChIKeyVMTJGDBWKBKRKG-UHFFFAOYSA-N
MW322.47 g/mol
LogP2.76
Rot. Bonds4

About N-(2-piperidin-1-ylcyclohexyl)benzenesulfonamide

N-(2-piperidin-1-ylcyclohexyl)benzenesulfonamide (PubChem CID 2912766) has the molecular formula C17H26N2O2S and a molecular weight of 322.47 g/mol. Its IUPAC name is N-(2-piperidin-1-ylcyclohexyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-piperidin-1-ylcyclohexyl)benzenesulfonamide
PubChem CID2912766
Molecular FormulaC17H26N2O2S
Molecular Weight322.47 g/mol
Exact Mass322.17
IUPAC NameN-(2-piperidin-1-ylcyclohexyl)benzenesulfonamide
SMILESO=S(=O)(NC1CCCCC1N1CCCCC1)c1ccccc1
InChIInChI=1S/C17H26N2O2S/c20-22(21,15-9-3-1-4-10-15)18-16-11-5-6-12-17(16)19-13-7-2-8-14-19/h1,3-4,9-10,16-18H,2,5-8,11-14H2
InChIKeyVMTJGDBWKBKRKG-UHFFFAOYSA-N
XLogP2.76
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.47
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-1-ylcyclohexyl)benzenesulfonamide?
The IUPAC name of N-(2-piperidin-1-ylcyclohexyl)benzenesulfonamide (CID 2912766) is N-(2-piperidin-1-ylcyclohexyl)benzenesulfonamide.
What is the SMILES notation for N-(2-piperidin-1-ylcyclohexyl)benzenesulfonamide?
The canonical SMILES for N-(2-piperidin-1-ylcyclohexyl)benzenesulfonamide is O=S(=O)(NC1CCCCC1N1CCCCC1)c1ccccc1.
What is the InChIKey of N-(2-piperidin-1-ylcyclohexyl)benzenesulfonamide?
The InChIKey is VMTJGDBWKBKRKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2S/c20-22(21,15-9-3-1-4-10-15)18-16-11-5-6-12-17(16)19-13-7-2-8-14-19/h1,3-4,9-10,16-18H,2,5-8,11-14H2.
What are the key properties of N-(2-piperidin-1-ylcyclohexyl)benzenesulfonamide?
N-(2-piperidin-1-ylcyclohexyl)benzenesulfonamide has a molecular weight of 322.47 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-1-ylcyclohexyl)benzenesulfonamide is sourced from PubChem (CID 2912766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).