2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-[[(2R)-oxolan-2-yl]methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen

C19H25N5O3 — CID 162209513

IUPAC2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-[[(2R)-oxolan-2-yl]methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen
SMILESCC(C)(O)c1ccc(-c2cnc3c(n2)N(C[C@H]2CCCO2)CC(=O)N3)cn1.[H][H]
InChIInChI=1S/C19H23N5O3.H2/c1-19(2,26)15-6-5-12(8-20-15)14-9-21-17-18(22-14)24(11-16(25)23-17)10-13-4-3-7-27-13;/h5-6,8-9,13,26H,3-4,7,10-11H2,1-2H3,(H,21,23,25);1H/t13-;/m1./s1
InChIKeyZSQQASHPRDMGNR-BTQNPOSSSA-N
MW371.44 g/mol
LogP1.95
Rot. Bonds4

About 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-[[(2R)-oxolan-2-yl]methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen

2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-[[(2R)-oxolan-2-yl]methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen (PubChem CID 162209513) has the molecular formula C19H25N5O3 and a molecular weight of 371.44 g/mol. Its IUPAC name is 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-[[(2R)-oxolan-2-yl]methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen.

Molecular Properties

Compound Name2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-[[(2R)-oxolan-2-yl]methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen
PubChem CID162209513
Molecular FormulaC19H25N5O3
Molecular Weight371.44 g/mol
Exact Mass371.20
IUPAC Name2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-[[(2R)-oxolan-2-yl]methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen
SMILESCC(C)(O)c1ccc(-c2cnc3c(n2)N(C[C@H]2CCCO2)CC(=O)N3)cn1.[H][H]
InChIInChI=1S/C19H23N5O3.H2/c1-19(2,26)15-6-5-12(8-20-15)14-9-21-17-18(22-14)24(11-16(25)23-17)10-13-4-3-7-27-13;/h5-6,8-9,13,26H,3-4,7,10-11H2,1-2H3,(H,21,23,25);1H/t13-;/m1./s1
InChIKeyZSQQASHPRDMGNR-BTQNPOSSSA-N
XLogP1.95
TPSA100.47 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-[[(2R)-oxolan-2-yl]methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen with MolForge

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Related Compounds

8-[[(2S)-oxolan-2-yl]methyl]-2-[4-(1H-1,2,4-triazol-5-yl)phenyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one
CID 46214722
8-cyclopentyl-2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;methanol;molecular hydrogen
CID 161067279
2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-phenyl-5,7-dihydropyrazino[2,3-b]pyrazin-6-one
CID 46215723
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
molecular hydrogen;8-[2-(oxan-4-yl)ethyl]-2-[4-(1H-1,2,4-triazol-5-yl)phenyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one
CID 159876397
8-(2-methoxyethyl)-2-[6-(1H-1,2,4-triazol-5-yl)-3-pyridinyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen
CID 158826689
3-methyl-1-(oxolan-2-ylmethyl)-3-phenylpiperazine-2,5-dione
CID 64881514
1-(oxolan-2-ylmethyl)piperazine-2,5-dione
CID 64872858
6-bromo-4-(oxolan-2-ylmethyl)-1,3-dihydroquinoxalin-2-one
CID 117006335
23-(oxolan-2-ylmethyl)-5,7,14,17,23,26,33-heptazapentacyclo[23.2.2.214,17.12,6.18,12]tritriaconta-1(27),2(33),3,5,8,10,12(32),25,28-nonaen-19-one
CID 146927022
4-(oxan-2-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64878807
3-cyclopropyl-1-(oxolan-2-ylmethyl)piperazine-2,5-dione
CID 64879241

Frequently Asked Questions

What is the IUPAC name of 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-[[(2R)-oxolan-2-yl]methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen?
The IUPAC name of 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-[[(2R)-oxolan-2-yl]methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen (CID 162209513) is 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-[[(2R)-oxolan-2-yl]methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen.
What is the SMILES notation for 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-[[(2R)-oxolan-2-yl]methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen?
The canonical SMILES for 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-[[(2R)-oxolan-2-yl]methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen is CC(C)(O)c1ccc(-c2cnc3c(n2)N(C[C@H]2CCCO2)CC(=O)N3)cn1.[H][H].
What is the InChIKey of 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-[[(2R)-oxolan-2-yl]methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen?
The InChIKey is ZSQQASHPRDMGNR-BTQNPOSSSA-N. The full InChI is InChI=1S/C19H23N5O3.H2/c1-19(2,26)15-6-5-12(8-20-15)14-9-21-17-18(22-14)24(11-16(25)23-17)10-13-4-3-7-27-13;/h5-6,8-9,13,26H,3-4,7,10-11H2,1-2H3,(H,21,23,25);1H/t13-;/m1./s1.
What are the key properties of 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-[[(2R)-oxolan-2-yl]methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen?
2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-[[(2R)-oxolan-2-yl]methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen has a molecular weight of 371.44 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-[[(2R)-oxolan-2-yl]methyl]-5,7-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen is sourced from PubChem (CID 162209513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).