2-(oxan-4-yl)-3-(1-pyridin-2-ylpiperidin-4-yl)oxypyrazine

C19H24N4O2 — CID 58548101

IUPAC2-(oxan-4-yl)-3-(1-pyridin-2-ylpiperidin-4-yl)oxypyrazine
SMILESc1ccc(N2CCC(Oc3nccnc3C3CCOCC3)CC2)nc1
InChIInChI=1S/C19H24N4O2/c1-2-8-20-17(3-1)23-11-4-16(5-12-23)25-19-18(21-9-10-22-19)15-6-13-24-14-7-15/h1-3,8-10,15-16H,4-7,11-14H2
InChIKeyMANCVQIUASRYTH-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.81
Rot. Bonds4

About 2-(oxan-4-yl)-3-(1-pyridin-2-ylpiperidin-4-yl)oxypyrazine

2-(oxan-4-yl)-3-(1-pyridin-2-ylpiperidin-4-yl)oxypyrazine (PubChem CID 58548101) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 2-(oxan-4-yl)-3-(1-pyridin-2-ylpiperidin-4-yl)oxypyrazine.

Molecular Properties

Compound Name2-(oxan-4-yl)-3-(1-pyridin-2-ylpiperidin-4-yl)oxypyrazine
PubChem CID58548101
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name2-(oxan-4-yl)-3-(1-pyridin-2-ylpiperidin-4-yl)oxypyrazine
SMILESc1ccc(N2CCC(Oc3nccnc3C3CCOCC3)CC2)nc1
InChIInChI=1S/C19H24N4O2/c1-2-8-20-17(3-1)23-11-4-16(5-12-23)25-19-18(21-9-10-22-19)15-6-13-24-14-7-15/h1-3,8-10,15-16H,4-7,11-14H2
InChIKeyMANCVQIUASRYTH-UHFFFAOYSA-N
XLogP2.81
TPSA60.37 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(oxan-4-yl)-3-(1-pyridin-2-ylpiperidin-4-yl)oxypyrazine?
The IUPAC name of 2-(oxan-4-yl)-3-(1-pyridin-2-ylpiperidin-4-yl)oxypyrazine (CID 58548101) is 2-(oxan-4-yl)-3-(1-pyridin-2-ylpiperidin-4-yl)oxypyrazine.
What is the SMILES notation for 2-(oxan-4-yl)-3-(1-pyridin-2-ylpiperidin-4-yl)oxypyrazine?
The canonical SMILES for 2-(oxan-4-yl)-3-(1-pyridin-2-ylpiperidin-4-yl)oxypyrazine is c1ccc(N2CCC(Oc3nccnc3C3CCOCC3)CC2)nc1.
What is the InChIKey of 2-(oxan-4-yl)-3-(1-pyridin-2-ylpiperidin-4-yl)oxypyrazine?
The InChIKey is MANCVQIUASRYTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-2-8-20-17(3-1)23-11-4-16(5-12-23)25-19-18(21-9-10-22-19)15-6-13-24-14-7-15/h1-3,8-10,15-16H,4-7,11-14H2.
What are the key properties of 2-(oxan-4-yl)-3-(1-pyridin-2-ylpiperidin-4-yl)oxypyrazine?
2-(oxan-4-yl)-3-(1-pyridin-2-ylpiperidin-4-yl)oxypyrazine has a molecular weight of 340.43 g/mol, XLogP of 2.81, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxan-4-yl)-3-(1-pyridin-2-ylpiperidin-4-yl)oxypyrazine is sourced from PubChem (CID 58548101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).