3-bromo-5-(4-chlorophenyl)pyridin-2-amine

C11H8BrClN2 — CID 58067823

IUPAC3-bromo-5-(4-chlorophenyl)pyridin-2-amine
SMILESNc1ncc(-c2ccc(Cl)cc2)cc1Br
InChIInChI=1S/C11H8BrClN2/c12-10-5-8(6-15-11(10)14)7-1-3-9(13)4-2-7/h1-6H,(H2,14,15)
InChIKeyHGDZWURFOKDPAX-UHFFFAOYSA-N
MW283.56 g/mol
LogP3.75
Rot. Bonds1

About 3-bromo-5-(4-chlorophenyl)pyridin-2-amine

3-bromo-5-(4-chlorophenyl)pyridin-2-amine (PubChem CID 58067823) has the molecular formula C11H8BrClN2 and a molecular weight of 283.56 g/mol. Its IUPAC name is 3-bromo-5-(4-chlorophenyl)pyridin-2-amine.

Molecular Properties

Compound Name3-bromo-5-(4-chlorophenyl)pyridin-2-amine
PubChem CID58067823
Molecular FormulaC11H8BrClN2
Molecular Weight283.56 g/mol
Exact Mass281.96
IUPAC Name3-bromo-5-(4-chlorophenyl)pyridin-2-amine
SMILESNc1ncc(-c2ccc(Cl)cc2)cc1Br
InChIInChI=1S/C11H8BrClN2/c12-10-5-8(6-15-11(10)14)7-1-3-9(13)4-2-7/h1-6H,(H2,14,15)
InChIKeyHGDZWURFOKDPAX-UHFFFAOYSA-N
XLogP3.75
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.56
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-(4-chlorophenyl)pyridin-2-amine?
The IUPAC name of 3-bromo-5-(4-chlorophenyl)pyridin-2-amine (CID 58067823) is 3-bromo-5-(4-chlorophenyl)pyridin-2-amine.
What is the SMILES notation for 3-bromo-5-(4-chlorophenyl)pyridin-2-amine?
The canonical SMILES for 3-bromo-5-(4-chlorophenyl)pyridin-2-amine is Nc1ncc(-c2ccc(Cl)cc2)cc1Br.
What is the InChIKey of 3-bromo-5-(4-chlorophenyl)pyridin-2-amine?
The InChIKey is HGDZWURFOKDPAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8BrClN2/c12-10-5-8(6-15-11(10)14)7-1-3-9(13)4-2-7/h1-6H,(H2,14,15).
What are the key properties of 3-bromo-5-(4-chlorophenyl)pyridin-2-amine?
3-bromo-5-(4-chlorophenyl)pyridin-2-amine has a molecular weight of 283.56 g/mol, XLogP of 3.75, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-(4-chlorophenyl)pyridin-2-amine is sourced from PubChem (CID 58067823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).