2-(5-bromo-3,6-dihydro-2H-pyridin-1-yl)pyridine

C10H11BrN2 — CID 131042110

IUPAC2-(5-bromo-3,6-dihydro-2H-pyridin-1-yl)pyridine
SMILESBrC1=CCCN(c2ccccn2)C1
InChIInChI=1S/C10H11BrN2/c11-9-4-3-7-13(8-9)10-5-1-2-6-12-10/h1-2,4-6H,3,7-8H2
InChIKeyUVSLHEFXXAQZHZ-UHFFFAOYSA-N
MW239.12 g/mol
LogP2.57
Rot. Bonds1

About 2-(5-bromo-3,6-dihydro-2H-pyridin-1-yl)pyridine

2-(5-bromo-3,6-dihydro-2H-pyridin-1-yl)pyridine (PubChem CID 131042110) has the molecular formula C10H11BrN2 and a molecular weight of 239.12 g/mol. Its IUPAC name is 2-(5-bromo-3,6-dihydro-2H-pyridin-1-yl)pyridine.

Molecular Properties

Compound Name2-(5-bromo-3,6-dihydro-2H-pyridin-1-yl)pyridine
PubChem CID131042110
Molecular FormulaC10H11BrN2
Molecular Weight239.12 g/mol
Exact Mass238.01
IUPAC Name2-(5-bromo-3,6-dihydro-2H-pyridin-1-yl)pyridine
SMILESBrC1=CCCN(c2ccccn2)C1
InChIInChI=1S/C10H11BrN2/c11-9-4-3-7-13(8-9)10-5-1-2-6-12-10/h1-2,4-6H,3,7-8H2
InChIKeyUVSLHEFXXAQZHZ-UHFFFAOYSA-N
XLogP2.57
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.12
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 143401045
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CID 3992659
2-(4-methylidenepiperidin-1-yl)pyridine
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1-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine
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5-bromo-1-[2-(bromomethyl)phenyl]-3,6-dihydro-2H-pyridine
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5-bromo-4-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine
CID 66341717
1-methyl-4-pyridin-2-yl-3,5-dihydro-2H-pyrido[2,3-e][1,4]diazepine
CID 97411735
1-(2-bromoethyl)-4-pyridin-2-ylpiperazine
CID 61288555
1-pyridin-1-ium-1-yl-4-pyridin-2-ylpiperazine
CID 123973526
methanamine;1-methyl-4-pyridin-2-ylpiperazine
CID 145148686
[2-bromo-6-(4-pyridin-2-ylpiperazin-1-yl)phenyl]methanamine
CID 114879434

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-3,6-dihydro-2H-pyridin-1-yl)pyridine?
The IUPAC name of 2-(5-bromo-3,6-dihydro-2H-pyridin-1-yl)pyridine (CID 131042110) is 2-(5-bromo-3,6-dihydro-2H-pyridin-1-yl)pyridine.
What is the SMILES notation for 2-(5-bromo-3,6-dihydro-2H-pyridin-1-yl)pyridine?
The canonical SMILES for 2-(5-bromo-3,6-dihydro-2H-pyridin-1-yl)pyridine is BrC1=CCCN(c2ccccn2)C1.
What is the InChIKey of 2-(5-bromo-3,6-dihydro-2H-pyridin-1-yl)pyridine?
The InChIKey is UVSLHEFXXAQZHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrN2/c11-9-4-3-7-13(8-9)10-5-1-2-6-12-10/h1-2,4-6H,3,7-8H2.
What are the key properties of 2-(5-bromo-3,6-dihydro-2H-pyridin-1-yl)pyridine?
2-(5-bromo-3,6-dihydro-2H-pyridin-1-yl)pyridine has a molecular weight of 239.12 g/mol, XLogP of 2.57, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-3,6-dihydro-2H-pyridin-1-yl)pyridine is sourced from PubChem (CID 131042110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).