5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one

C13H18N4O2 — CID 66716343

IUPAC5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
SMILESCOC1CCC(N2C(=O)CNc3nccnc32)CC1
InChIInChI=1S/C13H18N4O2/c1-19-10-4-2-9(3-5-10)17-11(18)8-16-12-13(17)15-7-6-14-12/h6-7,9-10H,2-5,8H2,1H3,(H,14,16)
InChIKeyPSOULGDORDHHTR-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.19
Rot. Bonds2

About 5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one

5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one (PubChem CID 66716343) has the molecular formula C13H18N4O2 and a molecular weight of 262.31 g/mol. Its IUPAC name is 5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one.

Molecular Properties

Compound Name5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
PubChem CID66716343
Molecular FormulaC13H18N4O2
Molecular Weight262.31 g/mol
Exact Mass262.14
IUPAC Name5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
SMILESCOC1CCC(N2C(=O)CNc3nccnc32)CC1
InChIInChI=1S/C13H18N4O2/c1-19-10-4-2-9(3-5-10)17-11(18)8-16-12-13(17)15-7-6-14-12/h6-7,9-10H,2-5,8H2,1H3,(H,14,16)
InChIKeyPSOULGDORDHHTR-UHFFFAOYSA-N
XLogP1.19
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[6-(2-hydroxypropanoyl)-3-pyridinyl]-5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
CID 172739416
8-[(4-methoxycyclohexyl)methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one
CID 160854933
5-cyclopropyl-7,8-dihydropteridin-6-one
CID 175812763
1-(4-methoxycyclohexyl)-4-phenyl-2-(1H-1,2,4-triazol-5-yl)-2H-pyrazino[2,3-b]pyrazin-3-one
CID 90099988
3-[6-(4H-imidazol-2-yl)-3-pyridinyl]-5-[(4-methoxycyclohexyl)methyl]-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
CID 153181286
1-(4-methoxycyclohexyl)imidazol-2-amine
CID 165480135
3-[1-(3-methyl-2-pyridinyl)pyrrolidin-3-yl]imidazolidine-2,4-dione
CID 121184009
4-(1-tert-butylpiperidin-4-yl)-6-methoxy-1,2-dihydropyrido[2,3-b]pyrazin-3-one;1H-pyrido[2,3-b][1,4]oxazine-2,3-dione
CID 160929911
3-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-5-(oxan-4-yl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen
CID 159072734
3-bromo-2-(4-methoxypiperidin-1-yl)pyridine
CID 61375060
3-methoxy-2,3,4,5-tetrahydro-1H-pyrido[2,3-b][1,4]diazepine
CID 106110896
3-cyclopropylimidazolidine-2,4-dione;2-(3,4,5-trifluorophenyl)pyridine
CID 143380599

Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one?
The IUPAC name of 5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one (CID 66716343) is 5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one.
What is the SMILES notation for 5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one?
The canonical SMILES for 5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one is COC1CCC(N2C(=O)CNc3nccnc32)CC1.
What is the InChIKey of 5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one?
The InChIKey is PSOULGDORDHHTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O2/c1-19-10-4-2-9(3-5-10)17-11(18)8-16-12-13(17)15-7-6-14-12/h6-7,9-10H,2-5,8H2,1H3,(H,14,16).
What are the key properties of 5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one?
5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one has a molecular weight of 262.31 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one is sourced from PubChem (CID 66716343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).