2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-(2-methoxyethyl)-5,7-dihydropyrazino[2,3-b]pyrazin-6-one

C17H21N5O3 — CID 59453087

IUPAC2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-(2-methoxyethyl)-5,7-dihydropyrazino[2,3-b]pyrazin-6-one
SMILESCOCCN1CC(=O)Nc2ncc(-c3ccc(C(C)(C)O)nc3)nc21
InChIInChI=1S/C17H21N5O3/c1-17(2,24)13-5-4-11(8-18-13)12-9-19-15-16(20-12)22(6-7-25-3)10-14(23)21-15/h4-5,8-9,24H,6-7,10H2,1-3H3,(H,19,21,23)
InChIKeyNJPJPESOUGQOMJ-UHFFFAOYSA-N
MW343.39 g/mol
LogP1.17
Rot. Bonds5

About 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-(2-methoxyethyl)-5,7-dihydropyrazino[2,3-b]pyrazin-6-one

2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-(2-methoxyethyl)-5,7-dihydropyrazino[2,3-b]pyrazin-6-one (PubChem CID 59453087) has the molecular formula C17H21N5O3 and a molecular weight of 343.39 g/mol. Its IUPAC name is 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-(2-methoxyethyl)-5,7-dihydropyrazino[2,3-b]pyrazin-6-one.

Molecular Properties

Compound Name2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-(2-methoxyethyl)-5,7-dihydropyrazino[2,3-b]pyrazin-6-one
PubChem CID59453087
Molecular FormulaC17H21N5O3
Molecular Weight343.39 g/mol
Exact Mass343.16
IUPAC Name2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-(2-methoxyethyl)-5,7-dihydropyrazino[2,3-b]pyrazin-6-one
SMILESCOCCN1CC(=O)Nc2ncc(-c3ccc(C(C)(C)O)nc3)nc21
InChIInChI=1S/C17H21N5O3/c1-17(2,24)13-5-4-11(8-18-13)12-9-19-15-16(20-12)22(6-7-25-3)10-14(23)21-15/h4-5,8-9,24H,6-7,10H2,1-3H3,(H,19,21,23)
InChIKeyNJPJPESOUGQOMJ-UHFFFAOYSA-N
XLogP1.17
TPSA100.47 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-(2-methoxyethyl)-5,7-dihydropyrazino[2,3-b]pyrazin-6-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-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-(2-methoxyethyl)-5,7-dihydropyrazino[2,3-b]pyrazin-6-one?
The IUPAC name of 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-(2-methoxyethyl)-5,7-dihydropyrazino[2,3-b]pyrazin-6-one (CID 59453087) is 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-(2-methoxyethyl)-5,7-dihydropyrazino[2,3-b]pyrazin-6-one.
What is the SMILES notation for 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-(2-methoxyethyl)-5,7-dihydropyrazino[2,3-b]pyrazin-6-one?
The canonical SMILES for 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-(2-methoxyethyl)-5,7-dihydropyrazino[2,3-b]pyrazin-6-one is COCCN1CC(=O)Nc2ncc(-c3ccc(C(C)(C)O)nc3)nc21.
What is the InChIKey of 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-(2-methoxyethyl)-5,7-dihydropyrazino[2,3-b]pyrazin-6-one?
The InChIKey is NJPJPESOUGQOMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5O3/c1-17(2,24)13-5-4-11(8-18-13)12-9-19-15-16(20-12)22(6-7-25-3)10-14(23)21-15/h4-5,8-9,24H,6-7,10H2,1-3H3,(H,19,21,23).
What are the key properties of 2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-(2-methoxyethyl)-5,7-dihydropyrazino[2,3-b]pyrazin-6-one?
2-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-8-(2-methoxyethyl)-5,7-dihydropyrazino[2,3-b]pyrazin-6-one has a molecular weight of 343.39 g/mol, XLogP of 1.17, 5 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-(2-methoxyethyl)-5,7-dihydropyrazino[2,3-b]pyrazin-6-one is sourced from PubChem (CID 59453087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).