2-N-(2,4-dibromophenyl)-4-methylpyridine-2,5-diamine

C12H11Br2N3 — CID 79173349

IUPAC2-N-(2,4-dibromophenyl)-4-methylpyridine-2,5-diamine
SMILESCc1cc(Nc2ccc(Br)cc2Br)ncc1N
InChIInChI=1S/C12H11Br2N3/c1-7-4-12(16-6-10(7)15)17-11-3-2-8(13)5-9(11)14/h2-6H,15H2,1H3,(H,16,17)
InChIKeyZVDNWPURMPJDMV-UHFFFAOYSA-N
MW357.05 g/mol
LogP4.24
Rot. Bonds2

About 2-N-(2,4-dibromophenyl)-4-methylpyridine-2,5-diamine

2-N-(2,4-dibromophenyl)-4-methylpyridine-2,5-diamine (PubChem CID 79173349) has the molecular formula C12H11Br2N3 and a molecular weight of 357.05 g/mol. Its IUPAC name is 2-N-(2,4-dibromophenyl)-4-methylpyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-(2,4-dibromophenyl)-4-methylpyridine-2,5-diamine
PubChem CID79173349
Molecular FormulaC12H11Br2N3
Molecular Weight357.05 g/mol
Exact Mass354.93
IUPAC Name2-N-(2,4-dibromophenyl)-4-methylpyridine-2,5-diamine
SMILESCc1cc(Nc2ccc(Br)cc2Br)ncc1N
InChIInChI=1S/C12H11Br2N3/c1-7-4-12(16-6-10(7)15)17-11-3-2-8(13)5-9(11)14/h2-6H,15H2,1H3,(H,16,17)
InChIKeyZVDNWPURMPJDMV-UHFFFAOYSA-N
XLogP4.24
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.05
LogP ≤ 54.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-(4-bromo-2-methylphenyl)-4-methylpyridin-2-amine
CID 114870136
2-N-(2-bromo-4-chlorophenyl)-5-methylpyridine-2,4-diamine
CID 83265167
5-bromo-N-(2-bromo-4-fluorophenyl)-4-methylpyridin-2-amine
CID 114870130
4-methyl-2-N-(2-methylsulfanylphenyl)pyridine-2,5-diamine
CID 107643430
4-methyl-2-N-phenylpyridine-2,5-diamine
CID 79002285
2-N-(2-methoxyphenyl)-4-methylpyridine-2,5-diamine
CID 79020929
N-(5-amino-4-methyl-2-pyridinyl)-2,5-dibromobenzenesulfonamide
CID 61293712
2-N-(3,4-dimethylphenyl)-4-methylpyridine-2,5-diamine
CID 79020766
2-N-(2,4-dibromophenyl)-6-propoxypyridine-2,5-diamine
CID 63402975
N-(2,4-dibromophenyl)-6-fluoropyrimidin-4-amine
CID 115416669
2-N-(4-iodophenyl)-4-methylpyridine-2,5-diamine
CID 79172818
2-N-(4-chlorophenyl)-4-methylpyridine-2,5-diamine
CID 79021207

Frequently Asked Questions

What is the IUPAC name of 2-N-(2,4-dibromophenyl)-4-methylpyridine-2,5-diamine?
The IUPAC name of 2-N-(2,4-dibromophenyl)-4-methylpyridine-2,5-diamine (CID 79173349) is 2-N-(2,4-dibromophenyl)-4-methylpyridine-2,5-diamine.
What is the SMILES notation for 2-N-(2,4-dibromophenyl)-4-methylpyridine-2,5-diamine?
The canonical SMILES for 2-N-(2,4-dibromophenyl)-4-methylpyridine-2,5-diamine is Cc1cc(Nc2ccc(Br)cc2Br)ncc1N.
What is the InChIKey of 2-N-(2,4-dibromophenyl)-4-methylpyridine-2,5-diamine?
The InChIKey is ZVDNWPURMPJDMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11Br2N3/c1-7-4-12(16-6-10(7)15)17-11-3-2-8(13)5-9(11)14/h2-6H,15H2,1H3,(H,16,17).
What are the key properties of 2-N-(2,4-dibromophenyl)-4-methylpyridine-2,5-diamine?
2-N-(2,4-dibromophenyl)-4-methylpyridine-2,5-diamine has a molecular weight of 357.05 g/mol, XLogP of 4.24, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2,4-dibromophenyl)-4-methylpyridine-2,5-diamine is sourced from PubChem (CID 79173349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).