6-bromo-N-(3-bromo-4-methylphenyl)pyridin-2-amine

C12H10Br2N2 — CID 63961760

IUPAC6-bromo-N-(3-bromo-4-methylphenyl)pyridin-2-amine
SMILESCc1ccc(Nc2cccc(Br)n2)cc1Br
InChIInChI=1S/C12H10Br2N2/c1-8-5-6-9(7-10(8)13)15-12-4-2-3-11(14)16-12/h2-7H,1H3,(H,15,16)
InChIKeyVYIKYWNBXSAHHA-UHFFFAOYSA-N
MW342.03 g/mol
LogP4.66
Rot. Bonds2

About 6-bromo-N-(3-bromo-4-methylphenyl)pyridin-2-amine

6-bromo-N-(3-bromo-4-methylphenyl)pyridin-2-amine (PubChem CID 63961760) has the molecular formula C12H10Br2N2 and a molecular weight of 342.03 g/mol. Its IUPAC name is 6-bromo-N-(3-bromo-4-methylphenyl)pyridin-2-amine.

Molecular Properties

Compound Name6-bromo-N-(3-bromo-4-methylphenyl)pyridin-2-amine
PubChem CID63961760
Molecular FormulaC12H10Br2N2
Molecular Weight342.03 g/mol
Exact Mass339.92
IUPAC Name6-bromo-N-(3-bromo-4-methylphenyl)pyridin-2-amine
SMILESCc1ccc(Nc2cccc(Br)n2)cc1Br
InChIInChI=1S/C12H10Br2N2/c1-8-5-6-9(7-10(8)13)15-12-4-2-3-11(14)16-12/h2-7H,1H3,(H,15,16)
InChIKeyVYIKYWNBXSAHHA-UHFFFAOYSA-N
XLogP4.66
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.03
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-bromo-N-(3,4-dimethoxyphenyl)pyridin-2-amine
CID 63961087
6-bromo-N-(4-propan-2-ylphenyl)pyridin-2-amine
CID 63962569
6-N-(4-bromo-3-methylphenyl)-2-N-methylpyridine-2,6-diamine
CID 80759559
4-N-(3-bromo-4-methylphenyl)-6-N,2-dimethylpyrimidine-4,6-diamine
CID 80829480
2-N-(3-bromo-4-methylphenyl)-4-N-(3-chlorophenyl)pyrimidine-2,4-diamine
CID 112903672
N-(3-bromo-4-methylphenyl)-2-tert-butyl-6-chloropyrimidin-4-amine
CID 80951056
6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine
CID 80755260
6-bromo-N-(3-ethoxyphenyl)pyridin-2-amine
CID 63961957
6-N-(3-bromo-4-methylphenyl)-4-N-tert-butyl-2-methylpyrimidine-4,6-diamine
CID 112875945
6-bromo-N-(4-ethoxy-3-fluorophenyl)pyridin-2-amine
CID 113399791
1-N-(6-bromo-2-pyridinyl)-4-N,4-N-diethylbenzene-1,4-diamine
CID 63963887
5-N-(3-bromo-4-methylphenyl)-3-N-(3-fluorophenyl)-1,2,4-triazine-3,5-diamine
CID 112967033

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-(3-bromo-4-methylphenyl)pyridin-2-amine?
The IUPAC name of 6-bromo-N-(3-bromo-4-methylphenyl)pyridin-2-amine (CID 63961760) is 6-bromo-N-(3-bromo-4-methylphenyl)pyridin-2-amine.
What is the SMILES notation for 6-bromo-N-(3-bromo-4-methylphenyl)pyridin-2-amine?
The canonical SMILES for 6-bromo-N-(3-bromo-4-methylphenyl)pyridin-2-amine is Cc1ccc(Nc2cccc(Br)n2)cc1Br.
What is the InChIKey of 6-bromo-N-(3-bromo-4-methylphenyl)pyridin-2-amine?
The InChIKey is VYIKYWNBXSAHHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Br2N2/c1-8-5-6-9(7-10(8)13)15-12-4-2-3-11(14)16-12/h2-7H,1H3,(H,15,16).
What are the key properties of 6-bromo-N-(3-bromo-4-methylphenyl)pyridin-2-amine?
6-bromo-N-(3-bromo-4-methylphenyl)pyridin-2-amine has a molecular weight of 342.03 g/mol, XLogP of 4.66, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-(3-bromo-4-methylphenyl)pyridin-2-amine is sourced from PubChem (CID 63961760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).