2-amino-5-bromo-N-(3-methylbutyl)pyridine-3-sulfonamide

C10H16BrN3O2S — CID 6623719

IUPAC2-amino-5-bromo-N-(3-methylbutyl)pyridine-3-sulfonamide
SMILESCC(C)CCNS(=O)(=O)c1cc(Br)cnc1N
InChIInChI=1S/C10H16BrN3O2S/c1-7(2)3-4-14-17(15,16)9-5-8(11)6-13-10(9)12/h5-7,14H,3-4H2,1-2H3,(H2,12,13)
InChIKeyGUGHVFARGZXWIF-UHFFFAOYSA-N
MW322.23 g/mol
LogP1.75
Rot. Bonds5

About 2-amino-5-bromo-N-(3-methylbutyl)pyridine-3-sulfonamide

2-amino-5-bromo-N-(3-methylbutyl)pyridine-3-sulfonamide (PubChem CID 6623719) has the molecular formula C10H16BrN3O2S and a molecular weight of 322.23 g/mol. Its IUPAC name is 2-amino-5-bromo-N-(3-methylbutyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-amino-5-bromo-N-(3-methylbutyl)pyridine-3-sulfonamide
PubChem CID6623719
Molecular FormulaC10H16BrN3O2S
Molecular Weight322.23 g/mol
Exact Mass321.01
IUPAC Name2-amino-5-bromo-N-(3-methylbutyl)pyridine-3-sulfonamide
SMILESCC(C)CCNS(=O)(=O)c1cc(Br)cnc1N
InChIInChI=1S/C10H16BrN3O2S/c1-7(2)3-4-14-17(15,16)9-5-8(11)6-13-10(9)12/h5-7,14H,3-4H2,1-2H3,(H2,12,13)
InChIKeyGUGHVFARGZXWIF-UHFFFAOYSA-N
XLogP1.75
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.23
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-amino-5-bromo-N-(3-methylbutyl)pyridine-3-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-bromo-N-(3-methylbutyl)pyridine-3-sulfonamide?
The IUPAC name of 2-amino-5-bromo-N-(3-methylbutyl)pyridine-3-sulfonamide (CID 6623719) is 2-amino-5-bromo-N-(3-methylbutyl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-amino-5-bromo-N-(3-methylbutyl)pyridine-3-sulfonamide?
The canonical SMILES for 2-amino-5-bromo-N-(3-methylbutyl)pyridine-3-sulfonamide is CC(C)CCNS(=O)(=O)c1cc(Br)cnc1N.
What is the InChIKey of 2-amino-5-bromo-N-(3-methylbutyl)pyridine-3-sulfonamide?
The InChIKey is GUGHVFARGZXWIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16BrN3O2S/c1-7(2)3-4-14-17(15,16)9-5-8(11)6-13-10(9)12/h5-7,14H,3-4H2,1-2H3,(H2,12,13).
What are the key properties of 2-amino-5-bromo-N-(3-methylbutyl)pyridine-3-sulfonamide?
2-amino-5-bromo-N-(3-methylbutyl)pyridine-3-sulfonamide has a molecular weight of 322.23 g/mol, XLogP of 1.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-bromo-N-(3-methylbutyl)pyridine-3-sulfonamide is sourced from PubChem (CID 6623719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).