5-bromo-6-methylpyridin-2-amine;6-methylpyridin-2-amine

C12H15BrN4 — CID 159081957

IUPAC5-bromo-6-methylpyridin-2-amine;6-methylpyridin-2-amine
SMILESCc1cccc(N)n1.Cc1nc(N)ccc1Br
InChIInChI=1S/C6H7BrN2.C6H8N2/c1-4-5(7)2-3-6(8)9-4;1-5-3-2-4-6(7)8-5/h2-3H,1H3,(H2,8,9);2-4H,1H3,(H2,7,8)
InChIKeyKAYVLZYKAXKWNF-UHFFFAOYSA-N
MW295.18 g/mol
LogP2.71
Rot. Bonds

About 5-bromo-6-methylpyridin-2-amine;6-methylpyridin-2-amine

5-bromo-6-methylpyridin-2-amine;6-methylpyridin-2-amine (PubChem CID 159081957) has the molecular formula C12H15BrN4 and a molecular weight of 295.18 g/mol. Its IUPAC name is 5-bromo-6-methylpyridin-2-amine;6-methylpyridin-2-amine.

Molecular Properties

Compound Name5-bromo-6-methylpyridin-2-amine;6-methylpyridin-2-amine
PubChem CID159081957
Molecular FormulaC12H15BrN4
Molecular Weight295.18 g/mol
Exact Mass294.05
IUPAC Name5-bromo-6-methylpyridin-2-amine;6-methylpyridin-2-amine
SMILESCc1cccc(N)n1.Cc1nc(N)ccc1Br
InChIInChI=1S/C6H7BrN2.C6H8N2/c1-4-5(7)2-3-6(8)9-4;1-5-3-2-4-6(7)8-5/h2-3H,1H3,(H2,8,9);2-4H,1H3,(H2,7,8)
InChIKeyKAYVLZYKAXKWNF-UHFFFAOYSA-N
XLogP2.71
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.18
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-methylpyridin-2-amine;6-methylpyridin-2-amine?
The IUPAC name of 5-bromo-6-methylpyridin-2-amine;6-methylpyridin-2-amine (CID 159081957) is 5-bromo-6-methylpyridin-2-amine;6-methylpyridin-2-amine.
What is the SMILES notation for 5-bromo-6-methylpyridin-2-amine;6-methylpyridin-2-amine?
The canonical SMILES for 5-bromo-6-methylpyridin-2-amine;6-methylpyridin-2-amine is Cc1cccc(N)n1.Cc1nc(N)ccc1Br.
What is the InChIKey of 5-bromo-6-methylpyridin-2-amine;6-methylpyridin-2-amine?
The InChIKey is KAYVLZYKAXKWNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7BrN2.C6H8N2/c1-4-5(7)2-3-6(8)9-4;1-5-3-2-4-6(7)8-5/h2-3H,1H3,(H2,8,9);2-4H,1H3,(H2,7,8).
What are the key properties of 5-bromo-6-methylpyridin-2-amine;6-methylpyridin-2-amine?
5-bromo-6-methylpyridin-2-amine;6-methylpyridin-2-amine has a molecular weight of 295.18 g/mol, XLogP of 2.71, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-methylpyridin-2-amine;6-methylpyridin-2-amine is sourced from PubChem (CID 159081957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).