2-amino-N-(4-butylphenyl)pyridine-4-sulfonamide

C15H19N3O2S — CID 62145322

IUPAC2-amino-N-(4-butylphenyl)pyridine-4-sulfonamide
SMILESCCCCc1ccc(NS(=O)(=O)c2ccnc(N)c2)cc1
InChIInChI=1S/C15H19N3O2S/c1-2-3-4-12-5-7-13(8-6-12)18-21(19,20)14-9-10-17-15(16)11-14/h5-11,18H,2-4H2,1H3,(H2,16,17)
InChIKeyCUHGVMAFLKIZQS-UHFFFAOYSA-N
MW305.40 g/mol
LogP2.81
Rot. Bonds6

About 2-amino-N-(4-butylphenyl)pyridine-4-sulfonamide

2-amino-N-(4-butylphenyl)pyridine-4-sulfonamide (PubChem CID 62145322) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is 2-amino-N-(4-butylphenyl)pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-amino-N-(4-butylphenyl)pyridine-4-sulfonamide
PubChem CID62145322
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC Name2-amino-N-(4-butylphenyl)pyridine-4-sulfonamide
SMILESCCCCc1ccc(NS(=O)(=O)c2ccnc(N)c2)cc1
InChIInChI=1S/C15H19N3O2S/c1-2-3-4-12-5-7-13(8-6-12)18-21(19,20)14-9-10-17-15(16)11-14/h5-11,18H,2-4H2,1H3,(H2,16,17)
InChIKeyCUHGVMAFLKIZQS-UHFFFAOYSA-N
XLogP2.81
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-butyl-N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]benzenesulfonamide
CID 19683735
5-bromo-N-(4-butylphenyl)pyridine-3-sulfonamide
CID 63422557
5-[(4-butylphenyl)sulfamoyl]-2-chlorobenzamide
CID 78785926
N-(4-butylphenyl)-3-iodo-4-methoxybenzenesulfonamide
CID 2975745
N-[4-[(4-butylphenyl)sulfonylamino]phenyl]acetamide
CID 22774827
4-pentyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzenesulfonamide
CID 3868589
N-(4-butylphenyl)-2,3-dihydro-1H-isoindole-5-sulfonamide;hydrochloride
CID 10126239
5-[(4-butylphenyl)sulfamoyl]-2-methylbenzoate
CID 7040597
5-[(4-butylphenyl)sulfamoyl]-2-hydroxybenzoic acid
CID 2133735
3-amino-4-fluoro-N-(4-propylphenyl)benzenesulfonamide
CID 43378598
N-(4-butylphenyl)-2,4,5-trichlorobenzenesulfonamide
CID 22773924
4-(3-propylsulfonylpropyl)pyridin-2-amine
CID 106731731

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-butylphenyl)pyridine-4-sulfonamide?
The IUPAC name of 2-amino-N-(4-butylphenyl)pyridine-4-sulfonamide (CID 62145322) is 2-amino-N-(4-butylphenyl)pyridine-4-sulfonamide.
What is the SMILES notation for 2-amino-N-(4-butylphenyl)pyridine-4-sulfonamide?
The canonical SMILES for 2-amino-N-(4-butylphenyl)pyridine-4-sulfonamide is CCCCc1ccc(NS(=O)(=O)c2ccnc(N)c2)cc1.
What is the InChIKey of 2-amino-N-(4-butylphenyl)pyridine-4-sulfonamide?
The InChIKey is CUHGVMAFLKIZQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-2-3-4-12-5-7-13(8-6-12)18-21(19,20)14-9-10-17-15(16)11-14/h5-11,18H,2-4H2,1H3,(H2,16,17).
What are the key properties of 2-amino-N-(4-butylphenyl)pyridine-4-sulfonamide?
2-amino-N-(4-butylphenyl)pyridine-4-sulfonamide has a molecular weight of 305.40 g/mol, XLogP of 2.81, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-butylphenyl)pyridine-4-sulfonamide is sourced from PubChem (CID 62145322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).