2-[(2-fluorophenyl)methoxy]-6-piperidin-1-ylpyrazine

C16H18FN3O — CID 152948377

IUPAC2-[(2-fluorophenyl)methoxy]-6-piperidin-1-ylpyrazine
SMILESFc1ccccc1COc1cncc(N2CCCCC2)n1
InChIInChI=1S/C16H18FN3O/c17-14-7-3-2-6-13(14)12-21-16-11-18-10-15(19-16)20-8-4-1-5-9-20/h2-3,6-7,10-11H,1,4-5,8-9,12H2
InChIKeyUOEWHCQIJYHQAF-UHFFFAOYSA-N
MW287.34 g/mol
LogP3.18
Rot. Bonds4

About 2-[(2-fluorophenyl)methoxy]-6-piperidin-1-ylpyrazine

2-[(2-fluorophenyl)methoxy]-6-piperidin-1-ylpyrazine (PubChem CID 152948377) has the molecular formula C16H18FN3O and a molecular weight of 287.34 g/mol. Its IUPAC name is 2-[(2-fluorophenyl)methoxy]-6-piperidin-1-ylpyrazine.

Molecular Properties

Compound Name2-[(2-fluorophenyl)methoxy]-6-piperidin-1-ylpyrazine
PubChem CID152948377
Molecular FormulaC16H18FN3O
Molecular Weight287.34 g/mol
Exact Mass287.14
IUPAC Name2-[(2-fluorophenyl)methoxy]-6-piperidin-1-ylpyrazine
SMILESFc1ccccc1COc1cncc(N2CCCCC2)n1
InChIInChI=1S/C16H18FN3O/c17-14-7-3-2-6-13(14)12-21-16-11-18-10-15(19-16)20-8-4-1-5-9-20/h2-3,6-7,10-11H,1,4-5,8-9,12H2
InChIKeyUOEWHCQIJYHQAF-UHFFFAOYSA-N
XLogP3.18
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-fluorophenyl)methoxy]-6-piperidin-1-ylpyrazine?
The IUPAC name of 2-[(2-fluorophenyl)methoxy]-6-piperidin-1-ylpyrazine (CID 152948377) is 2-[(2-fluorophenyl)methoxy]-6-piperidin-1-ylpyrazine.
What is the SMILES notation for 2-[(2-fluorophenyl)methoxy]-6-piperidin-1-ylpyrazine?
The canonical SMILES for 2-[(2-fluorophenyl)methoxy]-6-piperidin-1-ylpyrazine is Fc1ccccc1COc1cncc(N2CCCCC2)n1.
What is the InChIKey of 2-[(2-fluorophenyl)methoxy]-6-piperidin-1-ylpyrazine?
The InChIKey is UOEWHCQIJYHQAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN3O/c17-14-7-3-2-6-13(14)12-21-16-11-18-10-15(19-16)20-8-4-1-5-9-20/h2-3,6-7,10-11H,1,4-5,8-9,12H2.
What are the key properties of 2-[(2-fluorophenyl)methoxy]-6-piperidin-1-ylpyrazine?
2-[(2-fluorophenyl)methoxy]-6-piperidin-1-ylpyrazine has a molecular weight of 287.34 g/mol, XLogP of 3.18, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluorophenyl)methoxy]-6-piperidin-1-ylpyrazine is sourced from PubChem (CID 152948377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).