4-(6-cyclohexyloxypyrazin-2-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one

C18H24N6O2 — CID 127909579

IUPAC4-(6-cyclohexyloxypyrazin-2-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one
SMILESCn1cc(N2CCN(c3cncc(OC4CCCCC4)n3)CC2=O)cn1
InChIInChI=1S/C18H24N6O2/c1-22-12-14(9-20-22)24-8-7-23(13-18(24)25)16-10-19-11-17(21-16)26-15-5-3-2-4-6-15/h9-12,15H,2-8,13H2,1H3
InChIKeyFDERPWGYONOTEU-UHFFFAOYSA-N
MW356.43 g/mol
LogP1.77
Rot. Bonds4

About 4-(6-cyclohexyloxypyrazin-2-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one

4-(6-cyclohexyloxypyrazin-2-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one (PubChem CID 127909579) has the molecular formula C18H24N6O2 and a molecular weight of 356.43 g/mol. Its IUPAC name is 4-(6-cyclohexyloxypyrazin-2-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one.

Molecular Properties

Compound Name4-(6-cyclohexyloxypyrazin-2-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one
PubChem CID127909579
Molecular FormulaC18H24N6O2
Molecular Weight356.43 g/mol
Exact Mass356.20
IUPAC Name4-(6-cyclohexyloxypyrazin-2-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one
SMILESCn1cc(N2CCN(c3cncc(OC4CCCCC4)n3)CC2=O)cn1
InChIInChI=1S/C18H24N6O2/c1-22-12-14(9-20-22)24-8-7-23(13-18(24)25)16-10-19-11-17(21-16)26-15-5-3-2-4-6-15/h9-12,15H,2-8,13H2,1H3
InChIKeyFDERPWGYONOTEU-UHFFFAOYSA-N
XLogP1.77
TPSA76.38 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-(6-cyclohexyloxypyrazin-2-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one?
The IUPAC name of 4-(6-cyclohexyloxypyrazin-2-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one (CID 127909579) is 4-(6-cyclohexyloxypyrazin-2-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one.
What is the SMILES notation for 4-(6-cyclohexyloxypyrazin-2-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one?
The canonical SMILES for 4-(6-cyclohexyloxypyrazin-2-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one is Cn1cc(N2CCN(c3cncc(OC4CCCCC4)n3)CC2=O)cn1.
What is the InChIKey of 4-(6-cyclohexyloxypyrazin-2-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one?
The InChIKey is FDERPWGYONOTEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6O2/c1-22-12-14(9-20-22)24-8-7-23(13-18(24)25)16-10-19-11-17(21-16)26-15-5-3-2-4-6-15/h9-12,15H,2-8,13H2,1H3.
What are the key properties of 4-(6-cyclohexyloxypyrazin-2-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one?
4-(6-cyclohexyloxypyrazin-2-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one has a molecular weight of 356.43 g/mol, XLogP of 1.77, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-cyclohexyloxypyrazin-2-yl)-1-(1-methylpyrazol-4-yl)piperazin-2-one is sourced from PubChem (CID 127909579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).