2-(cyclopentylmethoxy)-6-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]pyrazine

C18H26N6O — CID 133485061

IUPAC2-(cyclopentylmethoxy)-6-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]pyrazine
SMILESCn1cc(N2CCN(c3cncc(OCC4CCCC4)n3)CC2)cn1
InChIInChI=1S/C18H26N6O/c1-22-13-16(10-20-22)23-6-8-24(9-7-23)17-11-19-12-18(21-17)25-14-15-4-2-3-5-15/h10-13,15H,2-9,14H2,1H3
InChIKeyXQGQYNOSDPIQRO-UHFFFAOYSA-N
MW342.45 g/mol
LogP2.11
Rot. Bonds5

About 2-(cyclopentylmethoxy)-6-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]pyrazine

2-(cyclopentylmethoxy)-6-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]pyrazine (PubChem CID 133485061) has the molecular formula C18H26N6O and a molecular weight of 342.45 g/mol. Its IUPAC name is 2-(cyclopentylmethoxy)-6-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]pyrazine.

Molecular Properties

Compound Name2-(cyclopentylmethoxy)-6-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]pyrazine
PubChem CID133485061
Molecular FormulaC18H26N6O
Molecular Weight342.45 g/mol
Exact Mass342.22
IUPAC Name2-(cyclopentylmethoxy)-6-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]pyrazine
SMILESCn1cc(N2CCN(c3cncc(OCC4CCCC4)n3)CC2)cn1
InChIInChI=1S/C18H26N6O/c1-22-13-16(10-20-22)23-6-8-24(9-7-23)17-11-19-12-18(21-17)25-14-15-4-2-3-5-15/h10-13,15H,2-9,14H2,1H3
InChIKeyXQGQYNOSDPIQRO-UHFFFAOYSA-N
XLogP2.11
TPSA59.31 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.45
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylmethoxy)-6-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]pyrazine?
The IUPAC name of 2-(cyclopentylmethoxy)-6-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]pyrazine (CID 133485061) is 2-(cyclopentylmethoxy)-6-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]pyrazine.
What is the SMILES notation for 2-(cyclopentylmethoxy)-6-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]pyrazine?
The canonical SMILES for 2-(cyclopentylmethoxy)-6-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]pyrazine is Cn1cc(N2CCN(c3cncc(OCC4CCCC4)n3)CC2)cn1.
What is the InChIKey of 2-(cyclopentylmethoxy)-6-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]pyrazine?
The InChIKey is XQGQYNOSDPIQRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N6O/c1-22-13-16(10-20-22)23-6-8-24(9-7-23)17-11-19-12-18(21-17)25-14-15-4-2-3-5-15/h10-13,15H,2-9,14H2,1H3.
What are the key properties of 2-(cyclopentylmethoxy)-6-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]pyrazine?
2-(cyclopentylmethoxy)-6-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]pyrazine has a molecular weight of 342.45 g/mol, XLogP of 2.11, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylmethoxy)-6-[4-(1-methylpyrazol-4-yl)piperazin-1-yl]pyrazine is sourced from PubChem (CID 133485061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).