5-[(5-bromo-2-pyridinyl)sulfonyl]pyridin-2-amine

C10H8BrN3O2S — CID 66582686

IUPAC5-[(5-bromo-2-pyridinyl)sulfonyl]pyridin-2-amine
SMILESNc1ccc(S(=O)(=O)c2ccc(Br)cn2)cn1
InChIInChI=1S/C10H8BrN3O2S/c11-7-1-4-10(14-5-7)17(15,16)8-2-3-9(12)13-6-8/h1-6H,(H2,12,13)
InChIKeyPJARZSQIZBXYFC-UHFFFAOYSA-N
MW314.16 g/mol
LogP1.65
Rot. Bonds2

About 5-[(5-bromo-2-pyridinyl)sulfonyl]pyridin-2-amine

5-[(5-bromo-2-pyridinyl)sulfonyl]pyridin-2-amine (PubChem CID 66582686) has the molecular formula C10H8BrN3O2S and a molecular weight of 314.16 g/mol. Its IUPAC name is 5-[(5-bromo-2-pyridinyl)sulfonyl]pyridin-2-amine.

Molecular Properties

Compound Name5-[(5-bromo-2-pyridinyl)sulfonyl]pyridin-2-amine
PubChem CID66582686
Molecular FormulaC10H8BrN3O2S
Molecular Weight314.16 g/mol
Exact Mass312.95
IUPAC Name5-[(5-bromo-2-pyridinyl)sulfonyl]pyridin-2-amine
SMILESNc1ccc(S(=O)(=O)c2ccc(Br)cn2)cn1
InChIInChI=1S/C10H8BrN3O2S/c11-7-1-4-10(14-5-7)17(15,16)8-2-3-9(12)13-6-8/h1-6H,(H2,12,13)
InChIKeyPJARZSQIZBXYFC-UHFFFAOYSA-N
XLogP1.65
TPSA85.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.16
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[(5-bromo-2-pyridinyl)sulfonyl]pyridin-2-amine?
The IUPAC name of 5-[(5-bromo-2-pyridinyl)sulfonyl]pyridin-2-amine (CID 66582686) is 5-[(5-bromo-2-pyridinyl)sulfonyl]pyridin-2-amine.
What is the SMILES notation for 5-[(5-bromo-2-pyridinyl)sulfonyl]pyridin-2-amine?
The canonical SMILES for 5-[(5-bromo-2-pyridinyl)sulfonyl]pyridin-2-amine is Nc1ccc(S(=O)(=O)c2ccc(Br)cn2)cn1.
What is the InChIKey of 5-[(5-bromo-2-pyridinyl)sulfonyl]pyridin-2-amine?
The InChIKey is PJARZSQIZBXYFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrN3O2S/c11-7-1-4-10(14-5-7)17(15,16)8-2-3-9(12)13-6-8/h1-6H,(H2,12,13).
What are the key properties of 5-[(5-bromo-2-pyridinyl)sulfonyl]pyridin-2-amine?
5-[(5-bromo-2-pyridinyl)sulfonyl]pyridin-2-amine has a molecular weight of 314.16 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(5-bromo-2-pyridinyl)sulfonyl]pyridin-2-amine is sourced from PubChem (CID 66582686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).