3-bromo-2-N-(2-bromo-5-methoxyphenyl)pyridine-2,5-diamine

C12H11Br2N3O — CID 79534385

IUPAC3-bromo-2-N-(2-bromo-5-methoxyphenyl)pyridine-2,5-diamine
SMILESCOc1ccc(Br)c(Nc2ncc(N)cc2Br)c1
InChIInChI=1S/C12H11Br2N3O/c1-18-8-2-3-9(13)11(5-8)17-12-10(14)4-7(15)6-16-12/h2-6H,15H2,1H3,(H,16,17)
InChIKeyDFDJGNZWEKMOHS-UHFFFAOYSA-N
MW373.05 g/mol
LogP3.94
Rot. Bonds3

About 3-bromo-2-N-(2-bromo-5-methoxyphenyl)pyridine-2,5-diamine

3-bromo-2-N-(2-bromo-5-methoxyphenyl)pyridine-2,5-diamine (PubChem CID 79534385) has the molecular formula C12H11Br2N3O and a molecular weight of 373.05 g/mol. Its IUPAC name is 3-bromo-2-N-(2-bromo-5-methoxyphenyl)pyridine-2,5-diamine.

Molecular Properties

Compound Name3-bromo-2-N-(2-bromo-5-methoxyphenyl)pyridine-2,5-diamine
PubChem CID79534385
Molecular FormulaC12H11Br2N3O
Molecular Weight373.05 g/mol
Exact Mass370.93
IUPAC Name3-bromo-2-N-(2-bromo-5-methoxyphenyl)pyridine-2,5-diamine
SMILESCOc1ccc(Br)c(Nc2ncc(N)cc2Br)c1
InChIInChI=1S/C12H11Br2N3O/c1-18-8-2-3-9(13)11(5-8)17-12-10(14)4-7(15)6-16-12/h2-6H,15H2,1H3,(H,16,17)
InChIKeyDFDJGNZWEKMOHS-UHFFFAOYSA-N
XLogP3.94
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.05
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-bromo-2-N-(3,5-dimethoxyphenyl)pyridine-2,5-diamine
CID 79531944
4-N-(2-bromo-5-methoxyphenyl)pyrimidine-4,5-diamine
CID 79918834
4-N-(2-bromo-5-methoxyphenyl)-5-chloropyrimidine-2,4-diamine
CID 80846775
3-bromo-2-N-(5-chloro-2,4-dimethoxyphenyl)pyridine-2,5-diamine
CID 79532276
N-(2-bromo-5-methoxyphenyl)-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 80924194
3-bromo-2-N-(3-chloro-4-methoxyphenyl)pyridine-2,5-diamine
CID 79531691
3-bromo-5-chloro-N-(2,4-dimethoxyphenyl)pyridin-2-amine
CID 114836602
4-N-(2-bromo-5-methoxyphenyl)quinazoline-2,4-diamine
CID 80829921
3-bromo-2-N-(2-fluoro-3-methylphenyl)pyridine-2,5-diamine
CID 114254112
5-bromo-6-(4-methoxyphenoxy)pyridin-3-amine
CID 79535113
4-N-(2-bromo-5-methoxyphenyl)-2-N-ethyl-5-methylpyrimidine-2,4-diamine
CID 80847879
4-N-(2-bromo-5-methoxyphenyl)-6-N-methyl-5-propan-2-ylpyrimidine-4,6-diamine
CID 80829815

Frequently Asked Questions

What is the IUPAC name of 3-bromo-2-N-(2-bromo-5-methoxyphenyl)pyridine-2,5-diamine?
The IUPAC name of 3-bromo-2-N-(2-bromo-5-methoxyphenyl)pyridine-2,5-diamine (CID 79534385) is 3-bromo-2-N-(2-bromo-5-methoxyphenyl)pyridine-2,5-diamine.
What is the SMILES notation for 3-bromo-2-N-(2-bromo-5-methoxyphenyl)pyridine-2,5-diamine?
The canonical SMILES for 3-bromo-2-N-(2-bromo-5-methoxyphenyl)pyridine-2,5-diamine is COc1ccc(Br)c(Nc2ncc(N)cc2Br)c1.
What is the InChIKey of 3-bromo-2-N-(2-bromo-5-methoxyphenyl)pyridine-2,5-diamine?
The InChIKey is DFDJGNZWEKMOHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11Br2N3O/c1-18-8-2-3-9(13)11(5-8)17-12-10(14)4-7(15)6-16-12/h2-6H,15H2,1H3,(H,16,17).
What are the key properties of 3-bromo-2-N-(2-bromo-5-methoxyphenyl)pyridine-2,5-diamine?
3-bromo-2-N-(2-bromo-5-methoxyphenyl)pyridine-2,5-diamine has a molecular weight of 373.05 g/mol, XLogP of 3.94, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2-N-(2-bromo-5-methoxyphenyl)pyridine-2,5-diamine is sourced from PubChem (CID 79534385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).