4-bromo-3-chloropyridin-2-amine

C5H4BrClN2 — CID 53485419

IUPAC4-bromo-3-chloropyridin-2-amine
SMILESNc1nccc(Br)c1Cl
InChIInChI=1S/C5H4BrClN2/c6-3-1-2-9-5(8)4(3)7/h1-2H,(H2,8,9)
InChIKeyRZMLRXSIZRAAAS-UHFFFAOYSA-N
MW207.46 g/mol
LogP2.08
Rot. Bonds

About 4-bromo-3-chloropyridin-2-amine

4-bromo-3-chloropyridin-2-amine (PubChem CID 53485419) has the molecular formula C5H4BrClN2 and a molecular weight of 207.46 g/mol. Its IUPAC name is 4-bromo-3-chloropyridin-2-amine.

Molecular Properties

Compound Name4-bromo-3-chloropyridin-2-amine
PubChem CID53485419
Molecular FormulaC5H4BrClN2
Molecular Weight207.46 g/mol
Exact Mass205.92
IUPAC Name4-bromo-3-chloropyridin-2-amine
SMILESNc1nccc(Br)c1Cl
InChIInChI=1S/C5H4BrClN2/c6-3-1-2-9-5(8)4(3)7/h1-2H,(H2,8,9)
InChIKeyRZMLRXSIZRAAAS-UHFFFAOYSA-N
XLogP2.08
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.46
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-bromo-3-chloropyridin-2-amine?
The IUPAC name of 4-bromo-3-chloropyridin-2-amine (CID 53485419) is 4-bromo-3-chloropyridin-2-amine.
What is the SMILES notation for 4-bromo-3-chloropyridin-2-amine?
The canonical SMILES for 4-bromo-3-chloropyridin-2-amine is Nc1nccc(Br)c1Cl.
What is the InChIKey of 4-bromo-3-chloropyridin-2-amine?
The InChIKey is RZMLRXSIZRAAAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4BrClN2/c6-3-1-2-9-5(8)4(3)7/h1-2H,(H2,8,9).
What are the key properties of 4-bromo-3-chloropyridin-2-amine?
4-bromo-3-chloropyridin-2-amine has a molecular weight of 207.46 g/mol, XLogP of 2.08, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-3-chloropyridin-2-amine is sourced from PubChem (CID 53485419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).