6-amino-N-octan-4-ylpyridine-3-sulfonamide

C13H23N3O2S — CID 106022026

IUPAC6-amino-N-octan-4-ylpyridine-3-sulfonamide
SMILESCCCCC(CCC)NS(=O)(=O)c1ccc(N)nc1
InChIInChI=1S/C13H23N3O2S/c1-3-5-7-11(6-4-2)16-19(17,18)12-8-9-13(14)15-10-12/h8-11,16H,3-7H2,1-2H3,(H2,14,15)
InChIKeyZHTPFMKFNMHJQR-UHFFFAOYSA-N
MW285.41 g/mol
LogP2.30
Rot. Bonds8

About 6-amino-N-octan-4-ylpyridine-3-sulfonamide

6-amino-N-octan-4-ylpyridine-3-sulfonamide (PubChem CID 106022026) has the molecular formula C13H23N3O2S and a molecular weight of 285.41 g/mol. Its IUPAC name is 6-amino-N-octan-4-ylpyridine-3-sulfonamide.

Molecular Properties

Compound Name6-amino-N-octan-4-ylpyridine-3-sulfonamide
PubChem CID106022026
Molecular FormulaC13H23N3O2S
Molecular Weight285.41 g/mol
Exact Mass285.15
IUPAC Name6-amino-N-octan-4-ylpyridine-3-sulfonamide
SMILESCCCCC(CCC)NS(=O)(=O)c1ccc(N)nc1
InChIInChI=1S/C13H23N3O2S/c1-3-5-7-11(6-4-2)16-19(17,18)12-8-9-13(14)15-10-12/h8-11,16H,3-7H2,1-2H3,(H2,14,15)
InChIKeyZHTPFMKFNMHJQR-UHFFFAOYSA-N
XLogP2.30
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.41
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-octan-4-ylpyrimidine-5-sulfonamide
CID 106027708
6-hydrazinyl-N-octan-4-ylpyridine-3-sulfonamide
CID 106025657
6-amino-N-pentan-3-ylpyridine-3-sulfonamide
CID 62148993
N-(1-aminohexan-2-yl)-6-nitropyridine-3-sulfonamide
CID 80696978
2-chloro-N-octan-4-ylpyridine-4-sulfonamide
CID 114138590
N-nonan-4-ylbenzenesulfonamide
CID 174769116
5-butylsulfonylpyridin-2-amine
CID 90010131
6-amino-N-(4-methoxybutan-2-yl)pyridine-3-sulfonamide
CID 64602408
4-fluoro-3-(hydroxymethyl)-N-octan-4-ylbenzenesulfonamide
CID 106022413
6-amino-N-(3,3-dimethylbutan-2-yl)pyridine-3-sulfonamide
CID 104827316
6-amino-N-(4-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide
CID 113484660
N-[(2S)-1-aminohexan-2-yl]pyridine-3-sulfonamide
CID 97225499

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-octan-4-ylpyridine-3-sulfonamide?
The IUPAC name of 6-amino-N-octan-4-ylpyridine-3-sulfonamide (CID 106022026) is 6-amino-N-octan-4-ylpyridine-3-sulfonamide.
What is the SMILES notation for 6-amino-N-octan-4-ylpyridine-3-sulfonamide?
The canonical SMILES for 6-amino-N-octan-4-ylpyridine-3-sulfonamide is CCCCC(CCC)NS(=O)(=O)c1ccc(N)nc1.
What is the InChIKey of 6-amino-N-octan-4-ylpyridine-3-sulfonamide?
The InChIKey is ZHTPFMKFNMHJQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2S/c1-3-5-7-11(6-4-2)16-19(17,18)12-8-9-13(14)15-10-12/h8-11,16H,3-7H2,1-2H3,(H2,14,15).
What are the key properties of 6-amino-N-octan-4-ylpyridine-3-sulfonamide?
6-amino-N-octan-4-ylpyridine-3-sulfonamide has a molecular weight of 285.41 g/mol, XLogP of 2.30, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-octan-4-ylpyridine-3-sulfonamide is sourced from PubChem (CID 106022026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).