2-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl)-3-(2-hydroxyethyl)quinazolin-4-one

C15H16N6O2 — CID 146140356

IUPAC2-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl)-3-(2-hydroxyethyl)quinazolin-4-one
SMILESO=c1c2ccccc2nc(N2CCn3ncnc3C2)n1CCO
InChIInChI=1S/C15H16N6O2/c22-8-7-20-14(23)11-3-1-2-4-12(11)18-15(20)19-5-6-21-13(9-19)16-10-17-21/h1-4,10,22H,5-9H2
InChIKeyNMZBADKQJBUTBI-UHFFFAOYSA-N
MW312.33 g/mol
LogP0.00
Rot. Bonds3

About 2-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl)-3-(2-hydroxyethyl)quinazolin-4-one

2-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl)-3-(2-hydroxyethyl)quinazolin-4-one (PubChem CID 146140356) has the molecular formula C15H16N6O2 and a molecular weight of 312.33 g/mol. Its IUPAC name is 2-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl)-3-(2-hydroxyethyl)quinazolin-4-one.

Molecular Properties

Compound Name2-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl)-3-(2-hydroxyethyl)quinazolin-4-one
PubChem CID146140356
Molecular FormulaC15H16N6O2
Molecular Weight312.33 g/mol
Exact Mass312.13
IUPAC Name2-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl)-3-(2-hydroxyethyl)quinazolin-4-one
SMILESO=c1c2ccccc2nc(N2CCn3ncnc3C2)n1CCO
InChIInChI=1S/C15H16N6O2/c22-8-7-20-14(23)11-3-1-2-4-12(11)18-15(20)19-5-6-21-13(9-19)16-10-17-21/h1-4,10,22H,5-9H2
InChIKeyNMZBADKQJBUTBI-UHFFFAOYSA-N
XLogP0.00
TPSA89.07 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.33
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 2-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl)-3-(2-hydroxyethyl)quinazolin-4-one with MolForge

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Related Compounds

3-(2-hydroxyethyl)-2-[2-[3-(2-hydroxyethyl)-4-oxoquinazolin-2-yl]ethyl]quinazolin-4-one
CID 139233007
3-(2-hydroxyethyl)-2-phenylquinazolin-4-one
CID 854542
3-[4-oxo-2-(4-propan-2-ylpiperazin-1-yl)quinazolin-3-yl]propanoic acid
CID 71563908
3-benzyl-2-pyrrolidin-1-ylquinazolin-4-one
CID 126457829
3-(2-hydroxyethyl)-2-(2-phenylethenyl)quinazolin-4-one
CID 71374590
3-(2-hydroxyethyl)-2-[1-(3-methyl-4-oxoquinazolin-2-yl)pyrrolidin-2-yl]quinazolin-4-one
CID 126951068
N-benzyl-3-(4-oxo-2-piperidin-1-ylquinazolin-3-yl)propanamide
CID 50844325
3-(2-hydroxyethyl)-2-[1-(pyrimidine-2-carbonyl)pyrrolidin-2-yl]quinazolin-4-one
CID 126950746
3-[(2-fluorophenyl)methyl]-2-piperazin-1-ylquinazolin-4-one
CID 71563914
3-(2-hydroxyethyl)-2-[1-(5-methylpyrimidin-2-yl)pyrrolidin-2-yl]quinazolin-4-one
CID 126951022
2-(4-chloroanilino)-3-(2-hydroxyethyl)quinazolin-4-one
CID 74766058
2-[1-(cyclopentanecarbonyl)pyrrolidin-2-yl]-3-(2-hydroxyethyl)quinazolin-4-one
CID 126950695

Frequently Asked Questions

What is the IUPAC name of 2-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl)-3-(2-hydroxyethyl)quinazolin-4-one?
The IUPAC name of 2-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl)-3-(2-hydroxyethyl)quinazolin-4-one (CID 146140356) is 2-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl)-3-(2-hydroxyethyl)quinazolin-4-one.
What is the SMILES notation for 2-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl)-3-(2-hydroxyethyl)quinazolin-4-one?
The canonical SMILES for 2-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl)-3-(2-hydroxyethyl)quinazolin-4-one is O=c1c2ccccc2nc(N2CCn3ncnc3C2)n1CCO.
What is the InChIKey of 2-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl)-3-(2-hydroxyethyl)quinazolin-4-one?
The InChIKey is NMZBADKQJBUTBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6O2/c22-8-7-20-14(23)11-3-1-2-4-12(11)18-15(20)19-5-6-21-13(9-19)16-10-17-21/h1-4,10,22H,5-9H2.
What are the key properties of 2-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl)-3-(2-hydroxyethyl)quinazolin-4-one?
2-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl)-3-(2-hydroxyethyl)quinazolin-4-one has a molecular weight of 312.33 g/mol, XLogP of 0.00, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl)-3-(2-hydroxyethyl)quinazolin-4-one is sourced from PubChem (CID 146140356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).