6-bromo-2-methoxypyridin-3-amine

C6H7BrN2O — CID 10536137

IUPAC6-bromo-2-methoxypyridin-3-amine
SMILESCOc1nc(Br)ccc1N
InChIInChI=1S/C6H7BrN2O/c1-10-6-4(8)2-3-5(7)9-6/h2-3H,8H2,1H3
InChIKeyHSVYYOLSYNEVSP-UHFFFAOYSA-N
MW203.04 g/mol
LogP1.43
Rot. Bonds1

About 6-bromo-2-methoxypyridin-3-amine

6-bromo-2-methoxypyridin-3-amine (PubChem CID 10536137) has the molecular formula C6H7BrN2O and a molecular weight of 203.04 g/mol. Its IUPAC name is 6-bromo-2-methoxypyridin-3-amine.

Molecular Properties

Compound Name6-bromo-2-methoxypyridin-3-amine
PubChem CID10536137
Molecular FormulaC6H7BrN2O
Molecular Weight203.04 g/mol
Exact Mass201.97
IUPAC Name6-bromo-2-methoxypyridin-3-amine
SMILESCOc1nc(Br)ccc1N
InChIInChI=1S/C6H7BrN2O/c1-10-6-4(8)2-3-5(7)9-6/h2-3H,8H2,1H3
InChIKeyHSVYYOLSYNEVSP-UHFFFAOYSA-N
XLogP1.43
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.04
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-methoxypyridin-3-amine?
The IUPAC name of 6-bromo-2-methoxypyridin-3-amine (CID 10536137) is 6-bromo-2-methoxypyridin-3-amine.
What is the SMILES notation for 6-bromo-2-methoxypyridin-3-amine?
The canonical SMILES for 6-bromo-2-methoxypyridin-3-amine is COc1nc(Br)ccc1N.
What is the InChIKey of 6-bromo-2-methoxypyridin-3-amine?
The InChIKey is HSVYYOLSYNEVSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7BrN2O/c1-10-6-4(8)2-3-5(7)9-6/h2-3H,8H2,1H3.
What are the key properties of 6-bromo-2-methoxypyridin-3-amine?
6-bromo-2-methoxypyridin-3-amine has a molecular weight of 203.04 g/mol, XLogP of 1.43, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-methoxypyridin-3-amine is sourced from PubChem (CID 10536137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).