4-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl)-3,4-dihydro-1H-quinolin-2-one

C15H15N5O2 — CID 75680753

IUPAC4-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CC(C(=O)N2CCn3ncnc3C2)c2ccccc2N1
InChIInChI=1S/C15H15N5O2/c21-14-7-11(10-3-1-2-4-12(10)18-14)15(22)19-5-6-20-13(8-19)16-9-17-20/h1-4,9,11H,5-8H2,(H,18,21)
InChIKeyORMXRJMYBMSGGE-UHFFFAOYSA-N
MW297.32 g/mol
LogP0.75
Rot. Bonds1

About 4-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl)-3,4-dihydro-1H-quinolin-2-one

4-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 75680753) has the molecular formula C15H15N5O2 and a molecular weight of 297.32 g/mol. Its IUPAC name is 4-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name4-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl)-3,4-dihydro-1H-quinolin-2-one
PubChem CID75680753
Molecular FormulaC15H15N5O2
Molecular Weight297.32 g/mol
Exact Mass297.12
IUPAC Name4-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CC(C(=O)N2CCn3ncnc3C2)c2ccccc2N1
InChIInChI=1S/C15H15N5O2/c21-14-7-11(10-3-1-2-4-12(10)18-14)15(22)19-5-6-20-13(8-19)16-9-17-20/h1-4,9,11H,5-8H2,(H,18,21)
InChIKeyORMXRJMYBMSGGE-UHFFFAOYSA-N
XLogP0.75
TPSA80.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.32
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 4-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl)-3,4-dihydro-1H-quinolin-2-one (CID 75680753) is 4-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 4-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 4-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl)-3,4-dihydro-1H-quinolin-2-one is O=C1CC(C(=O)N2CCn3ncnc3C2)c2ccccc2N1.
What is the InChIKey of 4-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is ORMXRJMYBMSGGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O2/c21-14-7-11(10-3-1-2-4-12(10)18-14)15(22)19-5-6-20-13(8-19)16-9-17-20/h1-4,9,11H,5-8H2,(H,18,21).
What are the key properties of 4-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl)-3,4-dihydro-1H-quinolin-2-one?
4-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 297.32 g/mol, XLogP of 0.75, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carbonyl)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 75680753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).