6-(5-bromo-3-pyridinyl)pyridin-2-amine

C10H8BrN3 — CID 119082124

IUPAC6-(5-bromo-3-pyridinyl)pyridin-2-amine
SMILESNc1cccc(-c2cncc(Br)c2)n1
InChIInChI=1S/C10H8BrN3/c11-8-4-7(5-13-6-8)9-2-1-3-10(12)14-9/h1-6H,(H2,12,14)
InChIKeyCPEKTYKXTFDBKV-UHFFFAOYSA-N
MW250.10 g/mol
LogP2.49
Rot. Bonds1

About 6-(5-bromo-3-pyridinyl)pyridin-2-amine

6-(5-bromo-3-pyridinyl)pyridin-2-amine (PubChem CID 119082124) has the molecular formula C10H8BrN3 and a molecular weight of 250.10 g/mol. Its IUPAC name is 6-(5-bromo-3-pyridinyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(5-bromo-3-pyridinyl)pyridin-2-amine
PubChem CID119082124
Molecular FormulaC10H8BrN3
Molecular Weight250.10 g/mol
Exact Mass248.99
IUPAC Name6-(5-bromo-3-pyridinyl)pyridin-2-amine
SMILESNc1cccc(-c2cncc(Br)c2)n1
InChIInChI=1S/C10H8BrN3/c11-8-4-7(5-13-6-8)9-2-1-3-10(12)14-9/h1-6H,(H2,12,14)
InChIKeyCPEKTYKXTFDBKV-UHFFFAOYSA-N
XLogP2.49
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.10
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(5-bromo-3-pyridinyl)pyridin-2-amine?
The IUPAC name of 6-(5-bromo-3-pyridinyl)pyridin-2-amine (CID 119082124) is 6-(5-bromo-3-pyridinyl)pyridin-2-amine.
What is the SMILES notation for 6-(5-bromo-3-pyridinyl)pyridin-2-amine?
The canonical SMILES for 6-(5-bromo-3-pyridinyl)pyridin-2-amine is Nc1cccc(-c2cncc(Br)c2)n1.
What is the InChIKey of 6-(5-bromo-3-pyridinyl)pyridin-2-amine?
The InChIKey is CPEKTYKXTFDBKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrN3/c11-8-4-7(5-13-6-8)9-2-1-3-10(12)14-9/h1-6H,(H2,12,14).
What are the key properties of 6-(5-bromo-3-pyridinyl)pyridin-2-amine?
6-(5-bromo-3-pyridinyl)pyridin-2-amine has a molecular weight of 250.10 g/mol, XLogP of 2.49, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-bromo-3-pyridinyl)pyridin-2-amine is sourced from PubChem (CID 119082124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).