2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxy-6-methylpyrazine

C15H17BrN4O — CID 171700909

IUPAC2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxy-6-methylpyrazine
SMILESCc1cncc(OC2CCN(c3ccc(Br)cn3)CC2)n1
InChIInChI=1S/C15H17BrN4O/c1-11-8-17-10-15(19-11)21-13-4-6-20(7-5-13)14-3-2-12(16)9-18-14/h2-3,8-10,13H,4-7H2,1H3
InChIKeyFUCCIUZTZAMFDE-UHFFFAOYSA-N
MW349.23 g/mol
LogP2.99
Rot. Bonds3

About 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxy-6-methylpyrazine

2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxy-6-methylpyrazine (PubChem CID 171700909) has the molecular formula C15H17BrN4O and a molecular weight of 349.23 g/mol. Its IUPAC name is 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxy-6-methylpyrazine.

Molecular Properties

Compound Name2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxy-6-methylpyrazine
PubChem CID171700909
Molecular FormulaC15H17BrN4O
Molecular Weight349.23 g/mol
Exact Mass348.06
IUPAC Name2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxy-6-methylpyrazine
SMILESCc1cncc(OC2CCN(c3ccc(Br)cn3)CC2)n1
InChIInChI=1S/C15H17BrN4O/c1-11-8-17-10-15(19-11)21-13-4-6-20(7-5-13)14-3-2-12(16)9-18-14/h2-3,8-10,13H,4-7H2,1H3
InChIKeyFUCCIUZTZAMFDE-UHFFFAOYSA-N
XLogP2.99
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.23
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]pyridine-3-carbonitrile
CID 171701933
2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine
CID 171701885
2-[1-(6-methoxypyrimidin-4-yl)piperidin-4-yl]oxy-6-methylpyrazine
CID 171702056
5-bromo-2-(4-ethoxypiperidin-1-yl)pyridine
CID 61374151
2-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]-1,3-thiazole
CID 171701828
2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]oxy-6-methylpyrazine
CID 171700905
2-methyl-5-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]-1,3,4-thiadiazole
CID 171701845
2-[1-[(2-bromophenyl)methyl]piperidin-4-yl]oxy-6-methylpyrazine
CID 171702340
1-(5-bromo-2-pyridinyl)piperidin-4-ol;[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxy-trimethylsilane
CID 67871907
2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxyethanamine
CID 82692276
5-bromo-2-[(3S)-3-(2,6-dichloro-4-methylphenoxy)pyrrolidin-1-yl]pyridine
CID 67148219
6-fluoro-4-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]quinazoline
CID 171702556

Frequently Asked Questions

What is the IUPAC name of 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxy-6-methylpyrazine?
The IUPAC name of 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxy-6-methylpyrazine (CID 171700909) is 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxy-6-methylpyrazine.
What is the SMILES notation for 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxy-6-methylpyrazine?
The canonical SMILES for 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxy-6-methylpyrazine is Cc1cncc(OC2CCN(c3ccc(Br)cn3)CC2)n1.
What is the InChIKey of 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxy-6-methylpyrazine?
The InChIKey is FUCCIUZTZAMFDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrN4O/c1-11-8-17-10-15(19-11)21-13-4-6-20(7-5-13)14-3-2-12(16)9-18-14/h2-3,8-10,13H,4-7H2,1H3.
What are the key properties of 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxy-6-methylpyrazine?
2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxy-6-methylpyrazine has a molecular weight of 349.23 g/mol, XLogP of 2.99, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]oxy-6-methylpyrazine is sourced from PubChem (CID 171700909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).