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

C14H22N4O2Sn — CID 66607099

IUPAC8-(oxan-4-yl)-2-trimethylstannyl-5,7-dihydropyrazino[2,3-b]pyrazin-6-one
SMILESC[Sn](C)(C)c1cnc2c(n1)N(C1CCOCC1)CC(=O)N2
InChIInChI=1S/C11H13N4O2.3CH3.Sn/c16-9-7-15(8-1-5-17-6-2-8)11-10(14-9)12-3-4-13-11;;;;/h3,8H,1-2,5-7H2,(H,12,14,16);3*1H3;
InChIKeyIYEQCLQQDHXALY-UHFFFAOYSA-N
MW397.07 g/mol
LogP0.96
Rot. Bonds2

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

8-(oxan-4-yl)-2-trimethylstannyl-5,7-dihydropyrazino[2,3-b]pyrazin-6-one (PubChem CID 66607099) has the molecular formula C14H22N4O2Sn and a molecular weight of 397.07 g/mol. Its IUPAC name is 8-(oxan-4-yl)-2-trimethylstannyl-5,7-dihydropyrazino[2,3-b]pyrazin-6-one.

Molecular Properties

Compound Name8-(oxan-4-yl)-2-trimethylstannyl-5,7-dihydropyrazino[2,3-b]pyrazin-6-one
PubChem CID66607099
Molecular FormulaC14H22N4O2Sn
Molecular Weight397.07 g/mol
Exact Mass398.08
IUPAC Name8-(oxan-4-yl)-2-trimethylstannyl-5,7-dihydropyrazino[2,3-b]pyrazin-6-one
SMILESC[Sn](C)(C)c1cnc2c(n1)N(C1CCOCC1)CC(=O)N2
InChIInChI=1S/C11H13N4O2.3CH3.Sn/c16-9-7-15(8-1-5-17-6-2-8)11-10(14-9)12-3-4-13-11;;;;/h3,8H,1-2,5-7H2,(H,12,14,16);3*1H3;
InChIKeyIYEQCLQQDHXALY-UHFFFAOYSA-N
XLogP0.96
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.07
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-(oxan-4-yl)-2-trimethylstannyl-5,7-dihydropyrazino[2,3-b]pyrazin-6-one?
The IUPAC name of 8-(oxan-4-yl)-2-trimethylstannyl-5,7-dihydropyrazino[2,3-b]pyrazin-6-one (CID 66607099) is 8-(oxan-4-yl)-2-trimethylstannyl-5,7-dihydropyrazino[2,3-b]pyrazin-6-one.
What is the SMILES notation for 8-(oxan-4-yl)-2-trimethylstannyl-5,7-dihydropyrazino[2,3-b]pyrazin-6-one?
The canonical SMILES for 8-(oxan-4-yl)-2-trimethylstannyl-5,7-dihydropyrazino[2,3-b]pyrazin-6-one is C[Sn](C)(C)c1cnc2c(n1)N(C1CCOCC1)CC(=O)N2.
What is the InChIKey of 8-(oxan-4-yl)-2-trimethylstannyl-5,7-dihydropyrazino[2,3-b]pyrazin-6-one?
The InChIKey is IYEQCLQQDHXALY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N4O2.3CH3.Sn/c16-9-7-15(8-1-5-17-6-2-8)11-10(14-9)12-3-4-13-11;;;;/h3,8H,1-2,5-7H2,(H,12,14,16);3*1H3;.
What are the key properties of 8-(oxan-4-yl)-2-trimethylstannyl-5,7-dihydropyrazino[2,3-b]pyrazin-6-one?
8-(oxan-4-yl)-2-trimethylstannyl-5,7-dihydropyrazino[2,3-b]pyrazin-6-one has a molecular weight of 397.07 g/mol, XLogP of 0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(oxan-4-yl)-2-trimethylstannyl-5,7-dihydropyrazino[2,3-b]pyrazin-6-one is sourced from PubChem (CID 66607099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).