N-(5-bromo-4-methyl-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide

C13H15BrN4O2S — CID 103306497

IUPACN-(5-bromo-4-methyl-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide
SMILESCCNc1cccnc1S(=O)(=O)Nc1cc(C)c(Br)cn1
InChIInChI=1S/C13H15BrN4O2S/c1-3-15-11-5-4-6-16-13(11)21(19,20)18-12-7-9(2)10(14)8-17-12/h4-8,15H,3H2,1-2H3,(H,17,18)
InChIKeyBTIYIQKZDGDQIZ-UHFFFAOYSA-N
MW371.26 g/mol
LogP2.78
Rot. Bonds5

About N-(5-bromo-4-methyl-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide

N-(5-bromo-4-methyl-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide (PubChem CID 103306497) has the molecular formula C13H15BrN4O2S and a molecular weight of 371.26 g/mol. Its IUPAC name is N-(5-bromo-4-methyl-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(5-bromo-4-methyl-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide
PubChem CID103306497
Molecular FormulaC13H15BrN4O2S
Molecular Weight371.26 g/mol
Exact Mass370.01
IUPAC NameN-(5-bromo-4-methyl-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide
SMILESCCNc1cccnc1S(=O)(=O)Nc1cc(C)c(Br)cn1
InChIInChI=1S/C13H15BrN4O2S/c1-3-15-11-5-4-6-16-13(11)21(19,20)18-12-7-9(2)10(14)8-17-12/h4-8,15H,3H2,1-2H3,(H,17,18)
InChIKeyBTIYIQKZDGDQIZ-UHFFFAOYSA-N
XLogP2.78
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.26
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-bromophenyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103303927
N-(3-bromo-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103306363
3-(ethylamino)-N-(6-methyl-2-pyridinyl)pyridine-2-sulfonamide
CID 103303472
N-(3-chloro-4-methylphenyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103303101
N-(5-methyl-2-pyridinyl)-3-(propylamino)pyridine-2-sulfonamide
CID 103303494
N-(4-chloro-2-iodophenyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 107630627
3-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-sulfonamide
CID 107642917
5-bromo-N-(ethylsulfamoyl)-4-methylpyridin-2-amine
CID 114808883
N-(2,4-difluorophenyl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103304014
N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-(ethylamino)pyridine-2-sulfonamide
CID 103304698
2,5-dibromo-N-(5-bromo-4-methyl-2-pyridinyl)benzenesulfonamide
CID 79729131
N-(5-bromo-4-methyl-2-pyridinyl)-2-(ethylaminomethyl)thiophene-3-sulfonamide
CID 106070832

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-4-methyl-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide?
The IUPAC name of N-(5-bromo-4-methyl-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide (CID 103306497) is N-(5-bromo-4-methyl-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide.
What is the SMILES notation for N-(5-bromo-4-methyl-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide?
The canonical SMILES for N-(5-bromo-4-methyl-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide is CCNc1cccnc1S(=O)(=O)Nc1cc(C)c(Br)cn1.
What is the InChIKey of N-(5-bromo-4-methyl-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide?
The InChIKey is BTIYIQKZDGDQIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15BrN4O2S/c1-3-15-11-5-4-6-16-13(11)21(19,20)18-12-7-9(2)10(14)8-17-12/h4-8,15H,3H2,1-2H3,(H,17,18).
What are the key properties of N-(5-bromo-4-methyl-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide?
N-(5-bromo-4-methyl-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide has a molecular weight of 371.26 g/mol, XLogP of 2.78, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-4-methyl-2-pyridinyl)-3-(ethylamino)pyridine-2-sulfonamide is sourced from PubChem (CID 103306497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).