6-chloro-N-(2,5-dibromophenyl)pyridin-2-amine

C11H7Br2ClN2 — CID 63588218

IUPAC6-chloro-N-(2,5-dibromophenyl)pyridin-2-amine
SMILESClc1cccc(Nc2cc(Br)ccc2Br)n1
InChIInChI=1S/C11H7Br2ClN2/c12-7-4-5-8(13)9(6-7)15-11-3-1-2-10(14)16-11/h1-6H,(H,15,16)
InChIKeyIPDUFASNXKEOLO-UHFFFAOYSA-N
MW362.45 g/mol
LogP5.00
Rot. Bonds2

About 6-chloro-N-(2,5-dibromophenyl)pyridin-2-amine

6-chloro-N-(2,5-dibromophenyl)pyridin-2-amine (PubChem CID 63588218) has the molecular formula C11H7Br2ClN2 and a molecular weight of 362.45 g/mol. Its IUPAC name is 6-chloro-N-(2,5-dibromophenyl)pyridin-2-amine.

Molecular Properties

Compound Name6-chloro-N-(2,5-dibromophenyl)pyridin-2-amine
PubChem CID63588218
Molecular FormulaC11H7Br2ClN2
Molecular Weight362.45 g/mol
Exact Mass359.87
IUPAC Name6-chloro-N-(2,5-dibromophenyl)pyridin-2-amine
SMILESClc1cccc(Nc2cc(Br)ccc2Br)n1
InChIInChI=1S/C11H7Br2ClN2/c12-7-4-5-8(13)9(6-7)15-11-3-1-2-10(14)16-11/h1-6H,(H,15,16)
InChIKeyIPDUFASNXKEOLO-UHFFFAOYSA-N
XLogP5.00
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.45
LogP ≤ 55.00
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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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2,5-dibromophenyl)pyridin-2-amine?
The IUPAC name of 6-chloro-N-(2,5-dibromophenyl)pyridin-2-amine (CID 63588218) is 6-chloro-N-(2,5-dibromophenyl)pyridin-2-amine.
What is the SMILES notation for 6-chloro-N-(2,5-dibromophenyl)pyridin-2-amine?
The canonical SMILES for 6-chloro-N-(2,5-dibromophenyl)pyridin-2-amine is Clc1cccc(Nc2cc(Br)ccc2Br)n1.
What is the InChIKey of 6-chloro-N-(2,5-dibromophenyl)pyridin-2-amine?
The InChIKey is IPDUFASNXKEOLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Br2ClN2/c12-7-4-5-8(13)9(6-7)15-11-3-1-2-10(14)16-11/h1-6H,(H,15,16).
What are the key properties of 6-chloro-N-(2,5-dibromophenyl)pyridin-2-amine?
6-chloro-N-(2,5-dibromophenyl)pyridin-2-amine has a molecular weight of 362.45 g/mol, XLogP of 5.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2,5-dibromophenyl)pyridin-2-amine is sourced from PubChem (CID 63588218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).