5-bromo-4-methyl-2-[(2R)-piperidin-2-yl]pyridine

C11H15BrN2 — CID 130618198

IUPAC5-bromo-4-methyl-2-[(2R)-piperidin-2-yl]pyridine
SMILESCc1cc([C@H]2CCCCN2)ncc1Br
InChIInChI=1S/C11H15BrN2/c1-8-6-11(14-7-9(8)12)10-4-2-3-5-13-10/h6-7,10,13H,2-5H2,1H3/t10-/m1/s1
InChIKeyCTFOUXBLWHXOOE-SNVBAGLBSA-N
MW255.16 g/mol
LogP2.97
Rot. Bonds1

About 5-bromo-4-methyl-2-[(2R)-piperidin-2-yl]pyridine

5-bromo-4-methyl-2-[(2R)-piperidin-2-yl]pyridine (PubChem CID 130618198) has the molecular formula C11H15BrN2 and a molecular weight of 255.16 g/mol. Its IUPAC name is 5-bromo-4-methyl-2-[(2R)-piperidin-2-yl]pyridine.

Molecular Properties

Compound Name5-bromo-4-methyl-2-[(2R)-piperidin-2-yl]pyridine
PubChem CID130618198
Molecular FormulaC11H15BrN2
Molecular Weight255.16 g/mol
Exact Mass254.04
IUPAC Name5-bromo-4-methyl-2-[(2R)-piperidin-2-yl]pyridine
SMILESCc1cc([C@H]2CCCCN2)ncc1Br
InChIInChI=1S/C11H15BrN2/c1-8-6-11(14-7-9(8)12)10-4-2-3-5-13-10/h6-7,10,13H,2-5H2,1H3/t10-/m1/s1
InChIKeyCTFOUXBLWHXOOE-SNVBAGLBSA-N
XLogP2.97
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.16
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-methyl-2-[(2R)-piperidin-2-yl]pyridine?
The IUPAC name of 5-bromo-4-methyl-2-[(2R)-piperidin-2-yl]pyridine (CID 130618198) is 5-bromo-4-methyl-2-[(2R)-piperidin-2-yl]pyridine.
What is the SMILES notation for 5-bromo-4-methyl-2-[(2R)-piperidin-2-yl]pyridine?
The canonical SMILES for 5-bromo-4-methyl-2-[(2R)-piperidin-2-yl]pyridine is Cc1cc([C@H]2CCCCN2)ncc1Br.
What is the InChIKey of 5-bromo-4-methyl-2-[(2R)-piperidin-2-yl]pyridine?
The InChIKey is CTFOUXBLWHXOOE-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H15BrN2/c1-8-6-11(14-7-9(8)12)10-4-2-3-5-13-10/h6-7,10,13H,2-5H2,1H3/t10-/m1/s1.
What are the key properties of 5-bromo-4-methyl-2-[(2R)-piperidin-2-yl]pyridine?
5-bromo-4-methyl-2-[(2R)-piperidin-2-yl]pyridine has a molecular weight of 255.16 g/mol, XLogP of 2.97, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-methyl-2-[(2R)-piperidin-2-yl]pyridine is sourced from PubChem (CID 130618198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).