5-[[1-(2-methylpropyl)piperidin-4-yl]methyl]-N-pyrazin-2-ylpyrazin-2-amine

C18H26N6 — CID 95823663

IUPAC5-[[1-(2-methylpropyl)piperidin-4-yl]methyl]-N-pyrazin-2-ylpyrazin-2-amine
SMILESCC(C)CN1CCC(Cc2cnc(Nc3cnccn3)cn2)CC1
InChIInChI=1S/C18H26N6/c1-14(2)13-24-7-3-15(4-8-24)9-16-10-22-18(12-21-16)23-17-11-19-5-6-20-17/h5-6,10-12,14-15H,3-4,7-9,13H2,1-2H3,(H,20,22,23)
InChIKeyPPSUZNOBOJRNBS-UHFFFAOYSA-N
MW326.45 g/mol
LogP2.92
Rot. Bonds6

About 5-[[1-(2-methylpropyl)piperidin-4-yl]methyl]-N-pyrazin-2-ylpyrazin-2-amine

5-[[1-(2-methylpropyl)piperidin-4-yl]methyl]-N-pyrazin-2-ylpyrazin-2-amine (PubChem CID 95823663) has the molecular formula C18H26N6 and a molecular weight of 326.45 g/mol. Its IUPAC name is 5-[[1-(2-methylpropyl)piperidin-4-yl]methyl]-N-pyrazin-2-ylpyrazin-2-amine.

Molecular Properties

Compound Name5-[[1-(2-methylpropyl)piperidin-4-yl]methyl]-N-pyrazin-2-ylpyrazin-2-amine
PubChem CID95823663
Molecular FormulaC18H26N6
Molecular Weight326.45 g/mol
Exact Mass326.22
IUPAC Name5-[[1-(2-methylpropyl)piperidin-4-yl]methyl]-N-pyrazin-2-ylpyrazin-2-amine
SMILESCC(C)CN1CCC(Cc2cnc(Nc3cnccn3)cn2)CC1
InChIInChI=1S/C18H26N6/c1-14(2)13-24-7-3-15(4-8-24)9-16-10-22-18(12-21-16)23-17-11-19-5-6-20-17/h5-6,10-12,14-15H,3-4,7-9,13H2,1-2H3,(H,20,22,23)
InChIKeyPPSUZNOBOJRNBS-UHFFFAOYSA-N
XLogP2.92
TPSA66.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.45
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[[1-(2-methylpropyl)piperidin-4-yl]methyl]-N-pyrazin-2-ylpyrazin-2-amine?
The IUPAC name of 5-[[1-(2-methylpropyl)piperidin-4-yl]methyl]-N-pyrazin-2-ylpyrazin-2-amine (CID 95823663) is 5-[[1-(2-methylpropyl)piperidin-4-yl]methyl]-N-pyrazin-2-ylpyrazin-2-amine.
What is the SMILES notation for 5-[[1-(2-methylpropyl)piperidin-4-yl]methyl]-N-pyrazin-2-ylpyrazin-2-amine?
The canonical SMILES for 5-[[1-(2-methylpropyl)piperidin-4-yl]methyl]-N-pyrazin-2-ylpyrazin-2-amine is CC(C)CN1CCC(Cc2cnc(Nc3cnccn3)cn2)CC1.
What is the InChIKey of 5-[[1-(2-methylpropyl)piperidin-4-yl]methyl]-N-pyrazin-2-ylpyrazin-2-amine?
The InChIKey is PPSUZNOBOJRNBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N6/c1-14(2)13-24-7-3-15(4-8-24)9-16-10-22-18(12-21-16)23-17-11-19-5-6-20-17/h5-6,10-12,14-15H,3-4,7-9,13H2,1-2H3,(H,20,22,23).
What are the key properties of 5-[[1-(2-methylpropyl)piperidin-4-yl]methyl]-N-pyrazin-2-ylpyrazin-2-amine?
5-[[1-(2-methylpropyl)piperidin-4-yl]methyl]-N-pyrazin-2-ylpyrazin-2-amine has a molecular weight of 326.45 g/mol, XLogP of 2.92, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[1-(2-methylpropyl)piperidin-4-yl]methyl]-N-pyrazin-2-ylpyrazin-2-amine is sourced from PubChem (CID 95823663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).