5-bromo-3-(4-fluoropiperidin-1-yl)-2-methylpyridine

C11H14BrFN2 — CID 158135526

IUPAC5-bromo-3-(4-fluoropiperidin-1-yl)-2-methylpyridine
SMILESCc1ncc(Br)cc1N1CCC(F)CC1
InChIInChI=1S/C11H14BrFN2/c1-8-11(6-9(12)7-14-8)15-4-2-10(13)3-5-15/h6-7,10H,2-5H2,1H3
InChIKeyZZOOMPUGDYOZKK-UHFFFAOYSA-N
MW273.15 g/mol
LogP3.09
Rot. Bonds1

About 5-bromo-3-(4-fluoropiperidin-1-yl)-2-methylpyridine

5-bromo-3-(4-fluoropiperidin-1-yl)-2-methylpyridine (PubChem CID 158135526) has the molecular formula C11H14BrFN2 and a molecular weight of 273.15 g/mol. Its IUPAC name is 5-bromo-3-(4-fluoropiperidin-1-yl)-2-methylpyridine.

Molecular Properties

Compound Name5-bromo-3-(4-fluoropiperidin-1-yl)-2-methylpyridine
PubChem CID158135526
Molecular FormulaC11H14BrFN2
Molecular Weight273.15 g/mol
Exact Mass272.03
IUPAC Name5-bromo-3-(4-fluoropiperidin-1-yl)-2-methylpyridine
SMILESCc1ncc(Br)cc1N1CCC(F)CC1
InChIInChI=1S/C11H14BrFN2/c1-8-11(6-9(12)7-14-8)15-4-2-10(13)3-5-15/h6-7,10H,2-5H2,1H3
InChIKeyZZOOMPUGDYOZKK-UHFFFAOYSA-N
XLogP3.09
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.15
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-3-(4-fluoropiperidin-1-yl)-2-(trifluoromethyl)pyridine
CID 135388007
1-(5-bromo-3-methyl-2-pyridinyl)pyrrolidin-3-amine
CID 79718817
4-(aminomethyl)-1-(5-bromo-2-methyl-3-pyridinyl)pyrrolidin-2-one
CID 168659739
(5-bromo-2-methyl-3-pyridinyl)-[4-(trifluoromethyl)piperidin-1-yl]methanone
CID 168678080
4-(5-bromo-2-cyclohexyloxy-3-pyridinyl)morpholine
CID 167395778
5-bromo-2-(3-tert-butylpyrrolidin-1-yl)-3-fluoropyridine
CID 104925342
5-bromo-2-[4-(chloromethyl)piperidin-1-yl]-3-methylpyridine
CID 79718248
5-bromo-3-fluoro-2-(3-methylpyrrolidin-1-yl)pyridine
CID 104919102
3,5-dibromo-2-(3-bromo-4-methylpiperidin-1-yl)pyridine
CID 102960994
5-(4-cyclopropylpiperidin-1-yl)-4-methylpyrimidine
CID 176552549
1-(5-bromo-3-methyl-2-pyridinyl)-4-methylpiperidin-3-ol
CID 103896085
5-bromo-3-morpholin-4-ylpyridine-2-carbonitrile
CID 90456532

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-(4-fluoropiperidin-1-yl)-2-methylpyridine?
The IUPAC name of 5-bromo-3-(4-fluoropiperidin-1-yl)-2-methylpyridine (CID 158135526) is 5-bromo-3-(4-fluoropiperidin-1-yl)-2-methylpyridine.
What is the SMILES notation for 5-bromo-3-(4-fluoropiperidin-1-yl)-2-methylpyridine?
The canonical SMILES for 5-bromo-3-(4-fluoropiperidin-1-yl)-2-methylpyridine is Cc1ncc(Br)cc1N1CCC(F)CC1.
What is the InChIKey of 5-bromo-3-(4-fluoropiperidin-1-yl)-2-methylpyridine?
The InChIKey is ZZOOMPUGDYOZKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrFN2/c1-8-11(6-9(12)7-14-8)15-4-2-10(13)3-5-15/h6-7,10H,2-5H2,1H3.
What are the key properties of 5-bromo-3-(4-fluoropiperidin-1-yl)-2-methylpyridine?
5-bromo-3-(4-fluoropiperidin-1-yl)-2-methylpyridine has a molecular weight of 273.15 g/mol, XLogP of 3.09, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-(4-fluoropiperidin-1-yl)-2-methylpyridine is sourced from PubChem (CID 158135526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).