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

C11H9BrClN3 — CID 103481979

IUPAC5-N-(2-bromo-3-chlorophenyl)pyridine-3,5-diamine
SMILESNc1cncc(Nc2cccc(Cl)c2Br)c1
InChIInChI=1S/C11H9BrClN3/c12-11-9(13)2-1-3-10(11)16-8-4-7(14)5-15-6-8/h1-6,16H,14H2
InChIKeyWZJGLRFRQGIGSA-UHFFFAOYSA-N
MW298.57 g/mol
LogP3.82
Rot. Bonds2

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

5-N-(2-bromo-3-chlorophenyl)pyridine-3,5-diamine (PubChem CID 103481979) has the molecular formula C11H9BrClN3 and a molecular weight of 298.57 g/mol. Its IUPAC name is 5-N-(2-bromo-3-chlorophenyl)pyridine-3,5-diamine.

Molecular Properties

Compound Name5-N-(2-bromo-3-chlorophenyl)pyridine-3,5-diamine
PubChem CID103481979
Molecular FormulaC11H9BrClN3
Molecular Weight298.57 g/mol
Exact Mass296.97
IUPAC Name5-N-(2-bromo-3-chlorophenyl)pyridine-3,5-diamine
SMILESNc1cncc(Nc2cccc(Cl)c2Br)c1
InChIInChI=1S/C11H9BrClN3/c12-11-9(13)2-1-3-10(11)16-8-4-7(14)5-15-6-8/h1-6,16H,14H2
InChIKeyWZJGLRFRQGIGSA-UHFFFAOYSA-N
XLogP3.82
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.57
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-N-(2-bromophenyl)pyridine-3,5-diamine
CID 104532355
5-N-naphthalen-1-ylpyridine-3,5-diamine
CID 104532218
5-N-(3-bromophenyl)pyridine-3,5-diamine
CID 104532361
2-bromo-1-N-(2-bromo-3-chlorophenyl)benzene-1,4-diamine
CID 103477453
1-N-(2-bromo-3-chlorophenyl)-3-chlorobenzene-1,2-diamine
CID 103477400
5-N-(2-chlorothiophen-3-yl)pyridine-3,5-diamine
CID 130834562
1-N-(2-bromo-3-chlorophenyl)-2-fluorobenzene-1,4-diamine
CID 103477514
2-N-(2-bromo-3-chlorophenyl)quinoline-2,6-diamine
CID 103477533
2-[(5-amino-3-pyridinyl)amino]-4-bromobenzonitrile
CID 107801738
4-N-(2-bromo-3-chlorophenyl)-2-cyclopropylpyrimidine-4,6-diamine
CID 103481973
5-N-(5-bromo-2-methoxyphenyl)pyridine-3,5-diamine
CID 113423853
5-N-[4-chloro-2-(trifluoromethyl)phenyl]pyridine-3,5-diamine
CID 104532239

Frequently Asked Questions

What is the IUPAC name of 5-N-(2-bromo-3-chlorophenyl)pyridine-3,5-diamine?
The IUPAC name of 5-N-(2-bromo-3-chlorophenyl)pyridine-3,5-diamine (CID 103481979) is 5-N-(2-bromo-3-chlorophenyl)pyridine-3,5-diamine.
What is the SMILES notation for 5-N-(2-bromo-3-chlorophenyl)pyridine-3,5-diamine?
The canonical SMILES for 5-N-(2-bromo-3-chlorophenyl)pyridine-3,5-diamine is Nc1cncc(Nc2cccc(Cl)c2Br)c1.
What is the InChIKey of 5-N-(2-bromo-3-chlorophenyl)pyridine-3,5-diamine?
The InChIKey is WZJGLRFRQGIGSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrClN3/c12-11-9(13)2-1-3-10(11)16-8-4-7(14)5-15-6-8/h1-6,16H,14H2.
What are the key properties of 5-N-(2-bromo-3-chlorophenyl)pyridine-3,5-diamine?
5-N-(2-bromo-3-chlorophenyl)pyridine-3,5-diamine has a molecular weight of 298.57 g/mol, XLogP of 3.82, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2-bromo-3-chlorophenyl)pyridine-3,5-diamine is sourced from PubChem (CID 103481979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).