N-cyclopropyl-N-piperidin-4-ylbenzenesulfonamide

C14H20N2O2S — CID 2735904

IUPACN-cyclopropyl-N-piperidin-4-ylbenzenesulfonamide
SMILESO=S(=O)(c1ccccc1)N(C1CCNCC1)C1CC1
InChIInChI=1S/C14H20N2O2S/c17-19(18,14-4-2-1-3-5-14)16(12-6-7-12)13-8-10-15-11-9-13/h1-5,12-13,15H,6-11H2
InChIKeyGADOCUCQRAEUHG-UHFFFAOYSA-N
MW280.39 g/mol
LogP1.59
Rot. Bonds4

About N-cyclopropyl-N-piperidin-4-ylbenzenesulfonamide

N-cyclopropyl-N-piperidin-4-ylbenzenesulfonamide (PubChem CID 2735904) has the molecular formula C14H20N2O2S and a molecular weight of 280.39 g/mol. Its IUPAC name is N-cyclopropyl-N-piperidin-4-ylbenzenesulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-N-piperidin-4-ylbenzenesulfonamide
PubChem CID2735904
Molecular FormulaC14H20N2O2S
Molecular Weight280.39 g/mol
Exact Mass280.12
IUPAC NameN-cyclopropyl-N-piperidin-4-ylbenzenesulfonamide
SMILESO=S(=O)(c1ccccc1)N(C1CCNCC1)C1CC1
InChIInChI=1S/C14H20N2O2S/c17-19(18,14-4-2-1-3-5-14)16(12-6-7-12)13-8-10-15-11-9-13/h1-5,12-13,15H,6-11H2
InChIKeyGADOCUCQRAEUHG-UHFFFAOYSA-N
XLogP1.59
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-piperidin-4-ylbenzenesulfonamide?
The IUPAC name of N-cyclopropyl-N-piperidin-4-ylbenzenesulfonamide (CID 2735904) is N-cyclopropyl-N-piperidin-4-ylbenzenesulfonamide.
What is the SMILES notation for N-cyclopropyl-N-piperidin-4-ylbenzenesulfonamide?
The canonical SMILES for N-cyclopropyl-N-piperidin-4-ylbenzenesulfonamide is O=S(=O)(c1ccccc1)N(C1CCNCC1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-piperidin-4-ylbenzenesulfonamide?
The InChIKey is GADOCUCQRAEUHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2S/c17-19(18,14-4-2-1-3-5-14)16(12-6-7-12)13-8-10-15-11-9-13/h1-5,12-13,15H,6-11H2.
What are the key properties of N-cyclopropyl-N-piperidin-4-ylbenzenesulfonamide?
N-cyclopropyl-N-piperidin-4-ylbenzenesulfonamide has a molecular weight of 280.39 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-piperidin-4-ylbenzenesulfonamide is sourced from PubChem (CID 2735904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).