N-(5-bromo-3-pyridinyl)-3-methoxythiophene-2-sulfonamide

C10H9BrN2O3S2 — CID 166185385

IUPACN-(5-bromo-3-pyridinyl)-3-methoxythiophene-2-sulfonamide
SMILESCOc1ccsc1S(=O)(=O)Nc1cncc(Br)c1
InChIInChI=1S/C10H9BrN2O3S2/c1-16-9-2-3-17-10(9)18(14,15)13-8-4-7(11)5-12-6-8/h2-6,13H,1H3
InChIKeyABPKNYUOIOFHRC-UHFFFAOYSA-N
MW349.23 g/mol
LogP2.71
Rot. Bonds4

About N-(5-bromo-3-pyridinyl)-3-methoxythiophene-2-sulfonamide

N-(5-bromo-3-pyridinyl)-3-methoxythiophene-2-sulfonamide (PubChem CID 166185385) has the molecular formula C10H9BrN2O3S2 and a molecular weight of 349.23 g/mol. Its IUPAC name is N-(5-bromo-3-pyridinyl)-3-methoxythiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(5-bromo-3-pyridinyl)-3-methoxythiophene-2-sulfonamide
PubChem CID166185385
Molecular FormulaC10H9BrN2O3S2
Molecular Weight349.23 g/mol
Exact Mass347.92
IUPAC NameN-(5-bromo-3-pyridinyl)-3-methoxythiophene-2-sulfonamide
SMILESCOc1ccsc1S(=O)(=O)Nc1cncc(Br)c1
InChIInChI=1S/C10H9BrN2O3S2/c1-16-9-2-3-17-10(9)18(14,15)13-8-4-7(11)5-12-6-8/h2-6,13H,1H3
InChIKeyABPKNYUOIOFHRC-UHFFFAOYSA-N
XLogP2.71
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.23
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-3-pyridinyl)-3-methoxythiophene-2-sulfonamide?
The IUPAC name of N-(5-bromo-3-pyridinyl)-3-methoxythiophene-2-sulfonamide (CID 166185385) is N-(5-bromo-3-pyridinyl)-3-methoxythiophene-2-sulfonamide.
What is the SMILES notation for N-(5-bromo-3-pyridinyl)-3-methoxythiophene-2-sulfonamide?
The canonical SMILES for N-(5-bromo-3-pyridinyl)-3-methoxythiophene-2-sulfonamide is COc1ccsc1S(=O)(=O)Nc1cncc(Br)c1.
What is the InChIKey of N-(5-bromo-3-pyridinyl)-3-methoxythiophene-2-sulfonamide?
The InChIKey is ABPKNYUOIOFHRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrN2O3S2/c1-16-9-2-3-17-10(9)18(14,15)13-8-4-7(11)5-12-6-8/h2-6,13H,1H3.
What are the key properties of N-(5-bromo-3-pyridinyl)-3-methoxythiophene-2-sulfonamide?
N-(5-bromo-3-pyridinyl)-3-methoxythiophene-2-sulfonamide has a molecular weight of 349.23 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-3-pyridinyl)-3-methoxythiophene-2-sulfonamide is sourced from PubChem (CID 166185385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).