2,6-dibromo-N,N-dimethylpyridin-3-amine

C7H8Br2N2 — CID 11834674

IUPAC2,6-dibromo-N,N-dimethylpyridin-3-amine
SMILESCN(C)c1ccc(Br)nc1Br
InChIInChI=1S/C7H8Br2N2/c1-11(2)5-3-4-6(8)10-7(5)9/h3-4H,1-2H3
InChIKeyUTCRRWSIYDRMIV-UHFFFAOYSA-N
MW279.96 g/mol
LogP2.67
Rot. Bonds1

About 2,6-dibromo-N,N-dimethylpyridin-3-amine

2,6-dibromo-N,N-dimethylpyridin-3-amine (PubChem CID 11834674) has the molecular formula C7H8Br2N2 and a molecular weight of 279.96 g/mol. Its IUPAC name is 2,6-dibromo-N,N-dimethylpyridin-3-amine.

Molecular Properties

Compound Name2,6-dibromo-N,N-dimethylpyridin-3-amine
PubChem CID11834674
Molecular FormulaC7H8Br2N2
Molecular Weight279.96 g/mol
Exact Mass277.91
IUPAC Name2,6-dibromo-N,N-dimethylpyridin-3-amine
SMILESCN(C)c1ccc(Br)nc1Br
InChIInChI=1S/C7H8Br2N2/c1-11(2)5-3-4-6(8)10-7(5)9/h3-4H,1-2H3
InChIKeyUTCRRWSIYDRMIV-UHFFFAOYSA-N
XLogP2.67
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.96
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 2,6-dibromo-N,N-dimethylpyridin-3-amine?
The IUPAC name of 2,6-dibromo-N,N-dimethylpyridin-3-amine (CID 11834674) is 2,6-dibromo-N,N-dimethylpyridin-3-amine.
What is the SMILES notation for 2,6-dibromo-N,N-dimethylpyridin-3-amine?
The canonical SMILES for 2,6-dibromo-N,N-dimethylpyridin-3-amine is CN(C)c1ccc(Br)nc1Br.
What is the InChIKey of 2,6-dibromo-N,N-dimethylpyridin-3-amine?
The InChIKey is UTCRRWSIYDRMIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8Br2N2/c1-11(2)5-3-4-6(8)10-7(5)9/h3-4H,1-2H3.
What are the key properties of 2,6-dibromo-N,N-dimethylpyridin-3-amine?
2,6-dibromo-N,N-dimethylpyridin-3-amine has a molecular weight of 279.96 g/mol, XLogP of 2.67, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dibromo-N,N-dimethylpyridin-3-amine is sourced from PubChem (CID 11834674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).