5-bromo-3-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine

C12H17BrClN3 — CID 103582598

IUPAC5-bromo-3-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine
SMILESCC1CCCC(C)N1Nc1ncc(Br)cc1Cl
InChIInChI=1S/C12H17BrClN3/c1-8-4-3-5-9(2)17(8)16-12-11(14)6-10(13)7-15-12/h6-9H,3-5H2,1-2H3,(H,15,16)
InChIKeyOYEUPDBHUMSSIQ-UHFFFAOYSA-N
MW318.65 g/mol
LogP4.09
Rot. Bonds2

About 5-bromo-3-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine

5-bromo-3-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine (PubChem CID 103582598) has the molecular formula C12H17BrClN3 and a molecular weight of 318.65 g/mol. Its IUPAC name is 5-bromo-3-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-3-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine
PubChem CID103582598
Molecular FormulaC12H17BrClN3
Molecular Weight318.65 g/mol
Exact Mass317.03
IUPAC Name5-bromo-3-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine
SMILESCC1CCCC(C)N1Nc1ncc(Br)cc1Cl
InChIInChI=1S/C12H17BrClN3/c1-8-4-3-5-9(2)17(8)16-12-11(14)6-10(13)7-15-12/h6-9H,3-5H2,1-2H3,(H,15,16)
InChIKeyOYEUPDBHUMSSIQ-UHFFFAOYSA-N
XLogP4.09
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.65
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dichloro-N-(2,6-dimethylpiperidin-1-yl)-6-hydrazinylpyridin-2-amine
CID 102762504
5-bromo-3-chloro-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]pyridine
CID 103583473
5-chloro-N-(2,6-dimethylpiperidin-1-yl)-2-hydrazinylpyrimidin-4-amine
CID 83027879
3-bromo-N-(2,6-dimethylpiperidin-1-yl)-5-nitropyridin-2-amine
CID 83026346
5-bromo-3-chloro-N-pyrrol-1-ylpyridin-2-amine
CID 103582572
5-bromo-3-chloro-N-(1-methylpiperidin-4-yl)pyridin-2-amine
CID 103579990
6-chloro-N-(2,6-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine
CID 83020197
5-bromo-3-chloro-N-[2-(chloromethyl)cyclopentyl]pyridin-2-amine
CID 106365408
5-bromo-3-chloro-N-[[2-(chloromethyl)cyclopentyl]methyl]pyridin-2-amine
CID 103584118
5-bromo-3-chloro-N-[(4-methylcyclohexyl)methyl]pyridin-2-amine
CID 103582514
5-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine
CID 83026801
5-bromo-3-chloro-N-(2,2-dimethylcyclopropyl)pyridin-2-amine
CID 103582483

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine?
The IUPAC name of 5-bromo-3-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine (CID 103582598) is 5-bromo-3-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-3-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine?
The canonical SMILES for 5-bromo-3-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine is CC1CCCC(C)N1Nc1ncc(Br)cc1Cl.
What is the InChIKey of 5-bromo-3-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine?
The InChIKey is OYEUPDBHUMSSIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17BrClN3/c1-8-4-3-5-9(2)17(8)16-12-11(14)6-10(13)7-15-12/h6-9H,3-5H2,1-2H3,(H,15,16).
What are the key properties of 5-bromo-3-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine?
5-bromo-3-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine has a molecular weight of 318.65 g/mol, XLogP of 4.09, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridin-2-amine is sourced from PubChem (CID 103582598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).