5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-2-amine

C13H12BrClN2 — CID 103583097

IUPAC5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-2-amine
SMILESCc1cc(C)cc(Nc2ncc(Br)cc2Cl)c1
InChIInChI=1S/C13H12BrClN2/c1-8-3-9(2)5-11(4-8)17-13-12(15)6-10(14)7-16-13/h3-7H,1-2H3,(H,16,17)
InChIKeyAZQFBYBBRIMBAV-UHFFFAOYSA-N
MW311.61 g/mol
LogP4.86
Rot. Bonds2

About 5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-2-amine

5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-2-amine (PubChem CID 103583097) has the molecular formula C13H12BrClN2 and a molecular weight of 311.61 g/mol. Its IUPAC name is 5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-2-amine
PubChem CID103583097
Molecular FormulaC13H12BrClN2
Molecular Weight311.61 g/mol
Exact Mass309.99
IUPAC Name5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-2-amine
SMILESCc1cc(C)cc(Nc2ncc(Br)cc2Cl)c1
InChIInChI=1S/C13H12BrClN2/c1-8-3-9(2)5-11(4-8)17-13-12(15)6-10(14)7-16-13/h3-7H,1-2H3,(H,16,17)
InChIKeyAZQFBYBBRIMBAV-UHFFFAOYSA-N
XLogP4.86
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.61
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-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

Related Compounds

5-bromo-N-(4-bromo-2,6-dimethylphenyl)-3-chloropyridin-2-amine
CID 103583373
5-bromo-3-chloro-N-(1-methylpyrazol-4-yl)pyridin-2-amine
CID 103582386
5-bromo-3-chloro-N-(3-fluorophenyl)pyridin-2-amine
CID 103583086
5-bromo-N-(3,5-dimethylphenyl)pyrimidin-2-amine
CID 63874390
5-[(5-bromo-3-chloro-2-pyridinyl)amino]-2-methylisoindole-1,3-dione
CID 103583037
5-bromo-3-chloro-N-[3-(chloromethyl)phenyl]pyridin-2-amine
CID 103584097
5-bromo-N-(4-bromo-3-chlorophenyl)-3-methylpyridin-2-amine
CID 107616385
5-chloro-6-(3-fluoro-5-methylanilino)pyridine-3-carboxylic acid
CID 79049585
5-bromo-3-chloro-N-propylpyridin-2-amine
CID 82480708
5-chloro-N-(3,5-dimethylphenyl)-3-fluoropyridin-2-amine
CID 79727161
5-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)pyridin-2-amine
CID 103583157
5-bromo-N-(2-bromo-4-chlorophenyl)-3-chloropyridin-2-amine
CID 103583411

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-2-amine?
The IUPAC name of 5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-2-amine (CID 103583097) is 5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-2-amine?
The canonical SMILES for 5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-2-amine is Cc1cc(C)cc(Nc2ncc(Br)cc2Cl)c1.
What is the InChIKey of 5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-2-amine?
The InChIKey is AZQFBYBBRIMBAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12BrClN2/c1-8-3-9(2)5-11(4-8)17-13-12(15)6-10(14)7-16-13/h3-7H,1-2H3,(H,16,17).
What are the key properties of 5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-2-amine?
5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-2-amine has a molecular weight of 311.61 g/mol, XLogP of 4.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-2-amine is sourced from PubChem (CID 103583097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).