1-cyclopropyl-3-[4-(2-methylpropyl)-3-oxopiperazin-1-yl]pyrazin-2-one

C15H22N4O2 — CID 91650224

IUPAC1-cyclopropyl-3-[4-(2-methylpropyl)-3-oxopiperazin-1-yl]pyrazin-2-one
SMILESCC(C)CN1CCN(c2nccn(C3CC3)c2=O)CC1=O
InChIInChI=1S/C15H22N4O2/c1-11(2)9-17-7-8-18(10-13(17)20)14-15(21)19(6-5-16-14)12-3-4-12/h5-6,11-12H,3-4,7-10H2,1-2H3
InChIKeyWFVXBQGABQMHHW-UHFFFAOYSA-N
MW290.37 g/mol
LogP0.88
Rot. Bonds4

About 1-cyclopropyl-3-[4-(2-methylpropyl)-3-oxopiperazin-1-yl]pyrazin-2-one

1-cyclopropyl-3-[4-(2-methylpropyl)-3-oxopiperazin-1-yl]pyrazin-2-one (PubChem CID 91650224) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 1-cyclopropyl-3-[4-(2-methylpropyl)-3-oxopiperazin-1-yl]pyrazin-2-one.

Molecular Properties

Compound Name1-cyclopropyl-3-[4-(2-methylpropyl)-3-oxopiperazin-1-yl]pyrazin-2-one
PubChem CID91650224
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name1-cyclopropyl-3-[4-(2-methylpropyl)-3-oxopiperazin-1-yl]pyrazin-2-one
SMILESCC(C)CN1CCN(c2nccn(C3CC3)c2=O)CC1=O
InChIInChI=1S/C15H22N4O2/c1-11(2)9-17-7-8-18(10-13(17)20)14-15(21)19(6-5-16-14)12-3-4-12/h5-6,11-12H,3-4,7-10H2,1-2H3
InChIKeyWFVXBQGABQMHHW-UHFFFAOYSA-N
XLogP0.88
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-[4-(2-methylpropyl)-3-oxopiperazin-1-yl]pyrazin-2-one?
The IUPAC name of 1-cyclopropyl-3-[4-(2-methylpropyl)-3-oxopiperazin-1-yl]pyrazin-2-one (CID 91650224) is 1-cyclopropyl-3-[4-(2-methylpropyl)-3-oxopiperazin-1-yl]pyrazin-2-one.
What is the SMILES notation for 1-cyclopropyl-3-[4-(2-methylpropyl)-3-oxopiperazin-1-yl]pyrazin-2-one?
The canonical SMILES for 1-cyclopropyl-3-[4-(2-methylpropyl)-3-oxopiperazin-1-yl]pyrazin-2-one is CC(C)CN1CCN(c2nccn(C3CC3)c2=O)CC1=O.
What is the InChIKey of 1-cyclopropyl-3-[4-(2-methylpropyl)-3-oxopiperazin-1-yl]pyrazin-2-one?
The InChIKey is WFVXBQGABQMHHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-11(2)9-17-7-8-18(10-13(17)20)14-15(21)19(6-5-16-14)12-3-4-12/h5-6,11-12H,3-4,7-10H2,1-2H3.
What are the key properties of 1-cyclopropyl-3-[4-(2-methylpropyl)-3-oxopiperazin-1-yl]pyrazin-2-one?
1-cyclopropyl-3-[4-(2-methylpropyl)-3-oxopiperazin-1-yl]pyrazin-2-one has a molecular weight of 290.37 g/mol, XLogP of 0.88, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-[4-(2-methylpropyl)-3-oxopiperazin-1-yl]pyrazin-2-one is sourced from PubChem (CID 91650224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).