4-propyl-N-pyridin-2-ylbenzenesulfonamide

C14H16N2O2S — CID 3269642

IUPAC4-propyl-N-pyridin-2-ylbenzenesulfonamide
SMILESCCCc1ccc(S(=O)(=O)Nc2ccccn2)cc1
InChIInChI=1S/C14H16N2O2S/c1-2-5-12-7-9-13(10-8-12)19(17,18)16-14-6-3-4-11-15-14/h3-4,6-11H,2,5H2,1H3,(H,15,16)
InChIKeyXFDTTXIBSCDBSN-UHFFFAOYSA-N
MW276.36 g/mol
LogP2.83
Rot. Bonds5

About 4-propyl-N-pyridin-2-ylbenzenesulfonamide

4-propyl-N-pyridin-2-ylbenzenesulfonamide (PubChem CID 3269642) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is 4-propyl-N-pyridin-2-ylbenzenesulfonamide.

Molecular Properties

Compound Name4-propyl-N-pyridin-2-ylbenzenesulfonamide
PubChem CID3269642
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC Name4-propyl-N-pyridin-2-ylbenzenesulfonamide
SMILESCCCc1ccc(S(=O)(=O)Nc2ccccn2)cc1
InChIInChI=1S/C14H16N2O2S/c1-2-5-12-7-9-13(10-8-12)19(17,18)16-14-6-3-4-11-15-14/h3-4,6-11H,2,5H2,1H3,(H,15,16)
InChIKeyXFDTTXIBSCDBSN-UHFFFAOYSA-N
XLogP2.83
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-pentyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzenesulfonamide
CID 3868589
4-(4-propylphenoxy)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]butanamide
CID 19191432
4-(2-methylbutan-2-yl)-N-pyridin-2-ylbenzenesulfonamide
CID 3809998
4-propyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide
CID 3704165
N-(5-ethyl-1H-pyrazol-3-yl)-4-propylbenzenesulfonamide
CID 115701449
2-(ethylamino)-N-pyridin-2-ylpyrimidine-5-sulfonamide
CID 62149006
4-amino-N-pyridin-2-ylbenzenesulfonamide;hydrochloride
CID 68756822
4-[(4-ethoxyphenyl)sulfonylamino]-N-pyridin-2-ylbenzenesulfonamide
CID 92674441
N-[4-(pyridin-2-ylsulfamoyl)phenyl]propanamide
CID 725106
4-(benzylamino)-N-pyridin-2-ylbenzenesulfonamide
CID 67330648
N-(5-nitro-2-pyridinyl)-4-propylbenzenesulfonamide
CID 18774864
4-propyl-N-[5-(trifluoromethyl)-2-pyridinyl]benzenesulfonamide
CID 112773266

Frequently Asked Questions

What is the IUPAC name of 4-propyl-N-pyridin-2-ylbenzenesulfonamide?
The IUPAC name of 4-propyl-N-pyridin-2-ylbenzenesulfonamide (CID 3269642) is 4-propyl-N-pyridin-2-ylbenzenesulfonamide.
What is the SMILES notation for 4-propyl-N-pyridin-2-ylbenzenesulfonamide?
The canonical SMILES for 4-propyl-N-pyridin-2-ylbenzenesulfonamide is CCCc1ccc(S(=O)(=O)Nc2ccccn2)cc1.
What is the InChIKey of 4-propyl-N-pyridin-2-ylbenzenesulfonamide?
The InChIKey is XFDTTXIBSCDBSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c1-2-5-12-7-9-13(10-8-12)19(17,18)16-14-6-3-4-11-15-14/h3-4,6-11H,2,5H2,1H3,(H,15,16).
What are the key properties of 4-propyl-N-pyridin-2-ylbenzenesulfonamide?
4-propyl-N-pyridin-2-ylbenzenesulfonamide has a molecular weight of 276.36 g/mol, XLogP of 2.83, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propyl-N-pyridin-2-ylbenzenesulfonamide is sourced from PubChem (CID 3269642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).