4-[[6-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]morpholine

C16H27N5O — CID 91091051

IUPAC4-[[6-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]morpholine
SMILESCC(C)N1CCN(c2cncc(CN3CCOCC3)n2)CC1
InChIInChI=1S/C16H27N5O/c1-14(2)20-3-5-21(6-4-20)16-12-17-11-15(18-16)13-19-7-9-22-10-8-19/h11-12,14H,3-10,13H2,1-2H3
InChIKeyAKJIIOZODQKGHG-UHFFFAOYSA-N
MW305.43 g/mol
LogP0.84
Rot. Bonds4

About 4-[[6-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]morpholine

4-[[6-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]morpholine (PubChem CID 91091051) has the molecular formula C16H27N5O and a molecular weight of 305.43 g/mol. Its IUPAC name is 4-[[6-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[6-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]morpholine
PubChem CID91091051
Molecular FormulaC16H27N5O
Molecular Weight305.43 g/mol
Exact Mass305.22
IUPAC Name4-[[6-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]morpholine
SMILESCC(C)N1CCN(c2cncc(CN3CCOCC3)n2)CC1
InChIInChI=1S/C16H27N5O/c1-14(2)20-3-5-21(6-4-20)16-12-17-11-15(18-16)13-19-7-9-22-10-8-19/h11-12,14H,3-10,13H2,1-2H3
InChIKeyAKJIIOZODQKGHG-UHFFFAOYSA-N
XLogP0.84
TPSA44.73 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.43
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[[6-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]morpholine?
The IUPAC name of 4-[[6-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]morpholine (CID 91091051) is 4-[[6-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]morpholine.
What is the SMILES notation for 4-[[6-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]morpholine?
The canonical SMILES for 4-[[6-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]morpholine is CC(C)N1CCN(c2cncc(CN3CCOCC3)n2)CC1.
What is the InChIKey of 4-[[6-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]morpholine?
The InChIKey is AKJIIOZODQKGHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N5O/c1-14(2)20-3-5-21(6-4-20)16-12-17-11-15(18-16)13-19-7-9-22-10-8-19/h11-12,14H,3-10,13H2,1-2H3.
What are the key properties of 4-[[6-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]morpholine?
4-[[6-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]morpholine has a molecular weight of 305.43 g/mol, XLogP of 0.84, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[6-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]morpholine is sourced from PubChem (CID 91091051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).