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

C14H20N4O2 — CID 160854933

IUPAC8-[(4-methoxycyclohexyl)methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one
SMILESCOC1CCC(CN2CC(=O)Nc3nccnc32)CC1
InChIInChI=1S/C14H20N4O2/c1-20-11-4-2-10(3-5-11)8-18-9-12(19)17-13-14(18)16-7-6-15-13/h6-7,10-11H,2-5,8-9H2,1H3,(H,15,17,19)
InChIKeySJSWZDIVUYJCAI-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.44
Rot. Bonds3

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

8-[(4-methoxycyclohexyl)methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one (PubChem CID 160854933) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 8-[(4-methoxycyclohexyl)methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one.

Molecular Properties

Compound Name8-[(4-methoxycyclohexyl)methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one
PubChem CID160854933
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name8-[(4-methoxycyclohexyl)methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one
SMILESCOC1CCC(CN2CC(=O)Nc3nccnc32)CC1
InChIInChI=1S/C14H20N4O2/c1-20-11-4-2-10(3-5-11)8-18-9-12(19)17-13-14(18)16-7-6-15-13/h6-7,10-11H,2-5,8-9H2,1H3,(H,15,17,19)
InChIKeySJSWZDIVUYJCAI-UHFFFAOYSA-N
XLogP1.44
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-(Tetrahydro-2H-pyran-4-yl)ethyl)-7-(trimethylstannyl)-3,4-dihydropyrazino[2,3-b]pyrazin-2(1H)-one
CID 66606705
1-(((trans)-4-Methoxycyclohexyl)methyl)-7-(trimethylstannyl)-3,4-dihydropyrazino[2,3-b]pyrazin-2(1H)-one
CID 66607424
4-((cis)-4-Methoxycyclohexyl)-6-(trimethylstannyl)-3,4-dihydropyrazino[2,3-b]pyrazin-2(1H)-one
CID 66607908
5-[2-(Oxan-4-yl)ethyl]-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
CID 66716082
5-[(4-Hydroxycyclohexyl)methyl]-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
CID 66716178
2-(4-methoxycyclohexyl)-2,4-dihydro-1H-pyrazino[2,3-b]pyrazin-3-one
CID 66716267
5-(4-Methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
CID 66716343
8-(1-Ethoxycyclohexyl)-2-trimethylstannyl-5,7-dihydropyrazino[2,3-b]pyrazin-6-one
CID 67380595
5-(Cyclohexylmethyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
CID 68620302
6-Bromo-4-(2-(tetrahydro-2H-pyran-4-yl)ethyl)-3,4-dihydropyrazino[2,3-b]pyrazin-2(1H)-one
CID 71567083
6-Bromo-4-((cis)-4-methoxycyclohexyl)-3,4-dihydropyrazino[2,3-b]pyrazin-2(1H)-one
CID 86644649
7-Bromo-1-(((trans)-4-methoxycyclohexyl)methyl)-3,4-dihydropyrazino[2,3-b]pyrazin-2(1H)-one
CID 86696615

Frequently Asked Questions

What is the IUPAC name of 8-[(4-methoxycyclohexyl)methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one?
The IUPAC name of 8-[(4-methoxycyclohexyl)methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one (CID 160854933) is 8-[(4-methoxycyclohexyl)methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one.
What is the SMILES notation for 8-[(4-methoxycyclohexyl)methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one?
The canonical SMILES for 8-[(4-methoxycyclohexyl)methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one is COC1CCC(CN2CC(=O)Nc3nccnc32)CC1.
What is the InChIKey of 8-[(4-methoxycyclohexyl)methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one?
The InChIKey is SJSWZDIVUYJCAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-20-11-4-2-10(3-5-11)8-18-9-12(19)17-13-14(18)16-7-6-15-13/h6-7,10-11H,2-5,8-9H2,1H3,(H,15,17,19).
What are the key properties of 8-[(4-methoxycyclohexyl)methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one?
8-[(4-methoxycyclohexyl)methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one has a molecular weight of 276.34 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(4-methoxycyclohexyl)methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one is sourced from PubChem (CID 160854933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).