1-morpholin-4-yl-2-[4-(6-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]ethanone

C20H25N5O3 — CID 95843376

IUPAC1-morpholin-4-yl-2-[4-(6-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]ethanone
SMILESO=C(CN1CCC(c2cncc(Oc3cccnc3)n2)CC1)N1CCOCC1
InChIInChI=1S/C20H25N5O3/c26-20(25-8-10-27-11-9-25)15-24-6-3-16(4-7-24)18-13-22-14-19(23-18)28-17-2-1-5-21-12-17/h1-2,5,12-14,16H,3-4,6-11,15H2
InChIKeyPPMCFJYRQPEMIK-UHFFFAOYSA-N
MW383.45 g/mol
LogP1.70
Rot. Bonds5

About 1-morpholin-4-yl-2-[4-(6-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]ethanone

1-morpholin-4-yl-2-[4-(6-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]ethanone (PubChem CID 95843376) has the molecular formula C20H25N5O3 and a molecular weight of 383.45 g/mol. Its IUPAC name is 1-morpholin-4-yl-2-[4-(6-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-morpholin-4-yl-2-[4-(6-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]ethanone
PubChem CID95843376
Molecular FormulaC20H25N5O3
Molecular Weight383.45 g/mol
Exact Mass383.20
IUPAC Name1-morpholin-4-yl-2-[4-(6-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]ethanone
SMILESO=C(CN1CCC(c2cncc(Oc3cccnc3)n2)CC1)N1CCOCC1
InChIInChI=1S/C20H25N5O3/c26-20(25-8-10-27-11-9-25)15-24-6-3-16(4-7-24)18-13-22-14-19(23-18)28-17-2-1-5-21-12-17/h1-2,5,12-14,16H,3-4,6-11,15H2
InChIKeyPPMCFJYRQPEMIK-UHFFFAOYSA-N
XLogP1.70
TPSA80.68 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-2-[4-(6-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]ethanone?
The IUPAC name of 1-morpholin-4-yl-2-[4-(6-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]ethanone (CID 95843376) is 1-morpholin-4-yl-2-[4-(6-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]ethanone.
What is the SMILES notation for 1-morpholin-4-yl-2-[4-(6-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]ethanone?
The canonical SMILES for 1-morpholin-4-yl-2-[4-(6-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]ethanone is O=C(CN1CCC(c2cncc(Oc3cccnc3)n2)CC1)N1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-2-[4-(6-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]ethanone?
The InChIKey is PPMCFJYRQPEMIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O3/c26-20(25-8-10-27-11-9-25)15-24-6-3-16(4-7-24)18-13-22-14-19(23-18)28-17-2-1-5-21-12-17/h1-2,5,12-14,16H,3-4,6-11,15H2.
What are the key properties of 1-morpholin-4-yl-2-[4-(6-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]ethanone?
1-morpholin-4-yl-2-[4-(6-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]ethanone has a molecular weight of 383.45 g/mol, XLogP of 1.70, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-2-[4-(6-pyridin-3-yloxypyrazin-2-yl)piperidin-1-yl]ethanone is sourced from PubChem (CID 95843376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).