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

C11H16BrN3O2S2 — CID 103823754

IUPAC2-amino-5-bromo-N-(2-methylsulfanylcyclopentyl)pyridine-3-sulfonamide
SMILESCSC1CCCC1NS(=O)(=O)c1cc(Br)cnc1N
InChIInChI=1S/C11H16BrN3O2S2/c1-18-9-4-2-3-8(9)15-19(16,17)10-5-7(12)6-14-11(10)13/h5-6,8-9,15H,2-4H2,1H3,(H2,13,14)
InChIKeyYYXHTFMCZIQVQC-UHFFFAOYSA-N
MW366.31 g/mol
LogP1.99
Rot. Bonds4

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

2-amino-5-bromo-N-(2-methylsulfanylcyclopentyl)pyridine-3-sulfonamide (PubChem CID 103823754) has the molecular formula C11H16BrN3O2S2 and a molecular weight of 366.31 g/mol. Its IUPAC name is 2-amino-5-bromo-N-(2-methylsulfanylcyclopentyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-amino-5-bromo-N-(2-methylsulfanylcyclopentyl)pyridine-3-sulfonamide
PubChem CID103823754
Molecular FormulaC11H16BrN3O2S2
Molecular Weight366.31 g/mol
Exact Mass364.99
IUPAC Name2-amino-5-bromo-N-(2-methylsulfanylcyclopentyl)pyridine-3-sulfonamide
SMILESCSC1CCCC1NS(=O)(=O)c1cc(Br)cnc1N
InChIInChI=1S/C11H16BrN3O2S2/c1-18-9-4-2-3-8(9)15-19(16,17)10-5-7(12)6-14-11(10)13/h5-6,8-9,15H,2-4H2,1H3,(H2,13,14)
InChIKeyYYXHTFMCZIQVQC-UHFFFAOYSA-N
XLogP1.99
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.31
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-(2-methylsulfanylcyclopentyl)benzenesulfonamide
CID 104859269
5-bromo-2-methyl-N-(2-methylsulfanylcyclopentyl)thiophene-3-sulfonamide
CID 103748807
5-bromo-3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]sulfonylpyridin-2-amine
CID 104968716
4-(aminomethyl)-2-bromo-N-(2-methylsulfanylcyclopentyl)benzenesulfonamide
CID 106091659
5-(aminomethyl)-2-bromo-3-methyl-N-(2-methylsulfanylcyclopentyl)benzenesulfonamide
CID 106091811
3-amino-N-(2-methylsulfanylcyclopentyl)benzenesulfonamide
CID 113498458
2-amino-5-bromo-N-(1-cyclopropylbutan-2-yl)pyridine-3-sulfonamide
CID 63994409
2-amino-5-bromo-N-(4-bromo-2,6-dimethylphenyl)pyridine-3-sulfonamide
CID 62163149
2-chloro-N-(2-methylsulfanylcyclohexyl)pyrimidine-5-sulfonamide
CID 114122877
5-(aminomethyl)-2-methyl-N-(2-methylsulfanylcyclopentyl)furan-3-sulfonamide
CID 106091691
5-bromo-3-fluoro-N-(2-methylsulfanylcyclopentyl)pyridin-2-amine
CID 104924472
5-bromo-3-(cyclopropylmethylsulfonyl)pyridin-2-amine
CID 158819540

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-bromo-N-(2-methylsulfanylcyclopentyl)pyridine-3-sulfonamide?
The IUPAC name of 2-amino-5-bromo-N-(2-methylsulfanylcyclopentyl)pyridine-3-sulfonamide (CID 103823754) is 2-amino-5-bromo-N-(2-methylsulfanylcyclopentyl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-amino-5-bromo-N-(2-methylsulfanylcyclopentyl)pyridine-3-sulfonamide?
The canonical SMILES for 2-amino-5-bromo-N-(2-methylsulfanylcyclopentyl)pyridine-3-sulfonamide is CSC1CCCC1NS(=O)(=O)c1cc(Br)cnc1N.
What is the InChIKey of 2-amino-5-bromo-N-(2-methylsulfanylcyclopentyl)pyridine-3-sulfonamide?
The InChIKey is YYXHTFMCZIQVQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrN3O2S2/c1-18-9-4-2-3-8(9)15-19(16,17)10-5-7(12)6-14-11(10)13/h5-6,8-9,15H,2-4H2,1H3,(H2,13,14).
What are the key properties of 2-amino-5-bromo-N-(2-methylsulfanylcyclopentyl)pyridine-3-sulfonamide?
2-amino-5-bromo-N-(2-methylsulfanylcyclopentyl)pyridine-3-sulfonamide has a molecular weight of 366.31 g/mol, XLogP of 1.99, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-bromo-N-(2-methylsulfanylcyclopentyl)pyridine-3-sulfonamide is sourced from PubChem (CID 103823754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).