3-bromo-4-chloro-5-methylpyridin-2-amine

C6H6BrClN2 — CID 130058362

IUPAC3-bromo-4-chloro-5-methylpyridin-2-amine
SMILESCc1cnc(N)c(Br)c1Cl
InChIInChI=1S/C6H6BrClN2/c1-3-2-10-6(9)4(7)5(3)8/h2H,1H3,(H2,9,10)
InChIKeyIOYMTNLNXRIUKL-UHFFFAOYSA-N
MW221.48 g/mol
LogP2.39
Rot. Bonds

About 3-bromo-4-chloro-5-methylpyridin-2-amine

3-bromo-4-chloro-5-methylpyridin-2-amine (PubChem CID 130058362) has the molecular formula C6H6BrClN2 and a molecular weight of 221.48 g/mol. Its IUPAC name is 3-bromo-4-chloro-5-methylpyridin-2-amine.

Molecular Properties

Compound Name3-bromo-4-chloro-5-methylpyridin-2-amine
PubChem CID130058362
Molecular FormulaC6H6BrClN2
Molecular Weight221.48 g/mol
Exact Mass219.94
IUPAC Name3-bromo-4-chloro-5-methylpyridin-2-amine
SMILESCc1cnc(N)c(Br)c1Cl
InChIInChI=1S/C6H6BrClN2/c1-3-2-10-6(9)4(7)5(3)8/h2H,1H3,(H2,9,10)
InChIKeyIOYMTNLNXRIUKL-UHFFFAOYSA-N
XLogP2.39
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.48
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-bromo-4-chloro-5-methylpyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-bromo-4-chloro-5-methylpyridin-2-amine?
The IUPAC name of 3-bromo-4-chloro-5-methylpyridin-2-amine (CID 130058362) is 3-bromo-4-chloro-5-methylpyridin-2-amine.
What is the SMILES notation for 3-bromo-4-chloro-5-methylpyridin-2-amine?
The canonical SMILES for 3-bromo-4-chloro-5-methylpyridin-2-amine is Cc1cnc(N)c(Br)c1Cl.
What is the InChIKey of 3-bromo-4-chloro-5-methylpyridin-2-amine?
The InChIKey is IOYMTNLNXRIUKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6BrClN2/c1-3-2-10-6(9)4(7)5(3)8/h2H,1H3,(H2,9,10).
What are the key properties of 3-bromo-4-chloro-5-methylpyridin-2-amine?
3-bromo-4-chloro-5-methylpyridin-2-amine has a molecular weight of 221.48 g/mol, XLogP of 2.39, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-4-chloro-5-methylpyridin-2-amine is sourced from PubChem (CID 130058362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).