2-(4-methoxycyclohexyl)-2,4-dihydro-1H-pyrazino[2,3-b]pyrazin-3-one

C13H18N4O2 — CID 66716267

IUPAC2-(4-methoxycyclohexyl)-2,4-dihydro-1H-pyrazino[2,3-b]pyrazin-3-one
SMILESCOC1CCC(C2Nc3nccnc3NC2=O)CC1
InChIInChI=1S/C13H18N4O2/c1-19-9-4-2-8(3-5-9)10-13(18)17-12-11(16-10)14-6-7-15-12/h6-10H,2-5H2,1H3,(H,14,16)(H,15,17,18)
InChIKeyLMQFKPGZUPUQLJ-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.41
Rot. Bonds2

About 2-(4-methoxycyclohexyl)-2,4-dihydro-1H-pyrazino[2,3-b]pyrazin-3-one

2-(4-methoxycyclohexyl)-2,4-dihydro-1H-pyrazino[2,3-b]pyrazin-3-one (PubChem CID 66716267) has the molecular formula C13H18N4O2 and a molecular weight of 262.31 g/mol. Its IUPAC name is 2-(4-methoxycyclohexyl)-2,4-dihydro-1H-pyrazino[2,3-b]pyrazin-3-one.

Molecular Properties

Compound Name2-(4-methoxycyclohexyl)-2,4-dihydro-1H-pyrazino[2,3-b]pyrazin-3-one
PubChem CID66716267
Molecular FormulaC13H18N4O2
Molecular Weight262.31 g/mol
Exact Mass262.14
IUPAC Name2-(4-methoxycyclohexyl)-2,4-dihydro-1H-pyrazino[2,3-b]pyrazin-3-one
SMILESCOC1CCC(C2Nc3nccnc3NC2=O)CC1
InChIInChI=1S/C13H18N4O2/c1-19-9-4-2-8(3-5-9)10-13(18)17-12-11(16-10)14-6-7-15-12/h6-10H,2-5H2,1H3,(H,14,16)(H,15,17,18)
InChIKeyLMQFKPGZUPUQLJ-UHFFFAOYSA-N
XLogP1.41
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(4-methoxycyclohexyl)-2,4-dihydro-1H-pyrazino[2,3-b]pyrazin-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxycyclohexyl)-2,4-dihydro-1H-pyrazino[2,3-b]pyrazin-3-one?
The IUPAC name of 2-(4-methoxycyclohexyl)-2,4-dihydro-1H-pyrazino[2,3-b]pyrazin-3-one (CID 66716267) is 2-(4-methoxycyclohexyl)-2,4-dihydro-1H-pyrazino[2,3-b]pyrazin-3-one.
What is the SMILES notation for 2-(4-methoxycyclohexyl)-2,4-dihydro-1H-pyrazino[2,3-b]pyrazin-3-one?
The canonical SMILES for 2-(4-methoxycyclohexyl)-2,4-dihydro-1H-pyrazino[2,3-b]pyrazin-3-one is COC1CCC(C2Nc3nccnc3NC2=O)CC1.
What is the InChIKey of 2-(4-methoxycyclohexyl)-2,4-dihydro-1H-pyrazino[2,3-b]pyrazin-3-one?
The InChIKey is LMQFKPGZUPUQLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O2/c1-19-9-4-2-8(3-5-9)10-13(18)17-12-11(16-10)14-6-7-15-12/h6-10H,2-5H2,1H3,(H,14,16)(H,15,17,18).
What are the key properties of 2-(4-methoxycyclohexyl)-2,4-dihydro-1H-pyrazino[2,3-b]pyrazin-3-one?
2-(4-methoxycyclohexyl)-2,4-dihydro-1H-pyrazino[2,3-b]pyrazin-3-one has a molecular weight of 262.31 g/mol, XLogP of 1.41, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxycyclohexyl)-2,4-dihydro-1H-pyrazino[2,3-b]pyrazin-3-one is sourced from PubChem (CID 66716267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).