5-[(3-bromo-2-pyridinyl)oxy]pyridin-2-amine

C10H8BrN3O — CID 135246357

IUPAC5-[(3-bromo-2-pyridinyl)oxy]pyridin-2-amine
SMILESNc1ccc(Oc2ncccc2Br)cn1
InChIInChI=1S/C10H8BrN3O/c11-8-2-1-5-13-10(8)15-7-3-4-9(12)14-6-7/h1-6H,(H2,12,14)
InChIKeyZMRPDTYFWZOQLQ-UHFFFAOYSA-N
MW266.10 g/mol
LogP2.61
Rot. Bonds2

About 5-[(3-bromo-2-pyridinyl)oxy]pyridin-2-amine

5-[(3-bromo-2-pyridinyl)oxy]pyridin-2-amine (PubChem CID 135246357) has the molecular formula C10H8BrN3O and a molecular weight of 266.10 g/mol. Its IUPAC name is 5-[(3-bromo-2-pyridinyl)oxy]pyridin-2-amine.

Molecular Properties

Compound Name5-[(3-bromo-2-pyridinyl)oxy]pyridin-2-amine
PubChem CID135246357
Molecular FormulaC10H8BrN3O
Molecular Weight266.10 g/mol
Exact Mass264.99
IUPAC Name5-[(3-bromo-2-pyridinyl)oxy]pyridin-2-amine
SMILESNc1ccc(Oc2ncccc2Br)cn1
InChIInChI=1S/C10H8BrN3O/c11-8-2-1-5-13-10(8)15-7-3-4-9(12)14-6-7/h1-6H,(H2,12,14)
InChIKeyZMRPDTYFWZOQLQ-UHFFFAOYSA-N
XLogP2.61
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.10
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[(3-bromo-2-pyridinyl)oxy]pyridin-2-amine?
The IUPAC name of 5-[(3-bromo-2-pyridinyl)oxy]pyridin-2-amine (CID 135246357) is 5-[(3-bromo-2-pyridinyl)oxy]pyridin-2-amine.
What is the SMILES notation for 5-[(3-bromo-2-pyridinyl)oxy]pyridin-2-amine?
The canonical SMILES for 5-[(3-bromo-2-pyridinyl)oxy]pyridin-2-amine is Nc1ccc(Oc2ncccc2Br)cn1.
What is the InChIKey of 5-[(3-bromo-2-pyridinyl)oxy]pyridin-2-amine?
The InChIKey is ZMRPDTYFWZOQLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrN3O/c11-8-2-1-5-13-10(8)15-7-3-4-9(12)14-6-7/h1-6H,(H2,12,14).
What are the key properties of 5-[(3-bromo-2-pyridinyl)oxy]pyridin-2-amine?
5-[(3-bromo-2-pyridinyl)oxy]pyridin-2-amine has a molecular weight of 266.10 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-bromo-2-pyridinyl)oxy]pyridin-2-amine is sourced from PubChem (CID 135246357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).