5-bromo-3-chloro-N,N-dimethylpyridin-2-amine

C7H8BrClN2 — CID 82476283

IUPAC5-bromo-3-chloro-N,N-dimethylpyridin-2-amine
SMILESCN(C)c1ncc(Br)cc1Cl
InChIInChI=1S/C7H8BrClN2/c1-11(2)7-6(9)3-5(8)4-10-7/h3-4H,1-2H3
InChIKeyJJICYSQYWZTBNF-UHFFFAOYSA-N
MW235.51 g/mol
LogP2.56
Rot. Bonds1

About 5-bromo-3-chloro-N,N-dimethylpyridin-2-amine

5-bromo-3-chloro-N,N-dimethylpyridin-2-amine (PubChem CID 82476283) has the molecular formula C7H8BrClN2 and a molecular weight of 235.51 g/mol. Its IUPAC name is 5-bromo-3-chloro-N,N-dimethylpyridin-2-amine.

Molecular Properties

Compound Name5-bromo-3-chloro-N,N-dimethylpyridin-2-amine
PubChem CID82476283
Molecular FormulaC7H8BrClN2
Molecular Weight235.51 g/mol
Exact Mass233.96
IUPAC Name5-bromo-3-chloro-N,N-dimethylpyridin-2-amine
SMILESCN(C)c1ncc(Br)cc1Cl
InChIInChI=1S/C7H8BrClN2/c1-11(2)7-6(9)3-5(8)4-10-7/h3-4H,1-2H3
InChIKeyJJICYSQYWZTBNF-UHFFFAOYSA-N
XLogP2.56
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.51
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-chloro-N,N-dimethylpyridin-2-amine?
The IUPAC name of 5-bromo-3-chloro-N,N-dimethylpyridin-2-amine (CID 82476283) is 5-bromo-3-chloro-N,N-dimethylpyridin-2-amine.
What is the SMILES notation for 5-bromo-3-chloro-N,N-dimethylpyridin-2-amine?
The canonical SMILES for 5-bromo-3-chloro-N,N-dimethylpyridin-2-amine is CN(C)c1ncc(Br)cc1Cl.
What is the InChIKey of 5-bromo-3-chloro-N,N-dimethylpyridin-2-amine?
The InChIKey is JJICYSQYWZTBNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8BrClN2/c1-11(2)7-6(9)3-5(8)4-10-7/h3-4H,1-2H3.
What are the key properties of 5-bromo-3-chloro-N,N-dimethylpyridin-2-amine?
5-bromo-3-chloro-N,N-dimethylpyridin-2-amine has a molecular weight of 235.51 g/mol, XLogP of 2.56, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-chloro-N,N-dimethylpyridin-2-amine is sourced from PubChem (CID 82476283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).