3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5H-imidazo[1,5-a]quinoxalin-4-one

C15H11N5O2 — CID 19106539

IUPAC3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5H-imidazo[1,5-a]quinoxalin-4-one
SMILESO=c1[nH]c2ccccc2n2cnc(-c3nc(C4CC4)no3)c12
InChIInChI=1S/C15H11N5O2/c21-14-12-11(15-18-13(19-22-15)8-5-6-8)16-7-20(12)10-4-2-1-3-9(10)17-14/h1-4,7-8H,5-6H2,(H,17,21)
InChIKeyMBNWNTOHMVBCKL-UHFFFAOYSA-N
MW293.29 g/mol
LogP2.10
Rot. Bonds2

About 3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5H-imidazo[1,5-a]quinoxalin-4-one

3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5H-imidazo[1,5-a]quinoxalin-4-one (PubChem CID 19106539) has the molecular formula C15H11N5O2 and a molecular weight of 293.29 g/mol. Its IUPAC name is 3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5H-imidazo[1,5-a]quinoxalin-4-one.

Molecular Properties

Compound Name3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5H-imidazo[1,5-a]quinoxalin-4-one
PubChem CID19106539
Molecular FormulaC15H11N5O2
Molecular Weight293.29 g/mol
Exact Mass293.09
IUPAC Name3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5H-imidazo[1,5-a]quinoxalin-4-one
SMILESO=c1[nH]c2ccccc2n2cnc(-c3nc(C4CC4)no3)c12
InChIInChI=1S/C15H11N5O2/c21-14-12-11(15-18-13(19-22-15)8-5-6-8)16-7-20(12)10-4-2-1-3-9(10)17-14/h1-4,7-8H,5-6H2,(H,17,21)
InChIKeyMBNWNTOHMVBCKL-UHFFFAOYSA-N
XLogP2.10
TPSA89.08 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.29
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5H-imidazo[1,5-a]quinoxalin-4-one?
The IUPAC name of 3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5H-imidazo[1,5-a]quinoxalin-4-one (CID 19106539) is 3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5H-imidazo[1,5-a]quinoxalin-4-one.
What is the SMILES notation for 3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5H-imidazo[1,5-a]quinoxalin-4-one?
The canonical SMILES for 3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5H-imidazo[1,5-a]quinoxalin-4-one is O=c1[nH]c2ccccc2n2cnc(-c3nc(C4CC4)no3)c12.
What is the InChIKey of 3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5H-imidazo[1,5-a]quinoxalin-4-one?
The InChIKey is MBNWNTOHMVBCKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N5O2/c21-14-12-11(15-18-13(19-22-15)8-5-6-8)16-7-20(12)10-4-2-1-3-9(10)17-14/h1-4,7-8H,5-6H2,(H,17,21).
What are the key properties of 3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5H-imidazo[1,5-a]quinoxalin-4-one?
3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5H-imidazo[1,5-a]quinoxalin-4-one has a molecular weight of 293.29 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-5H-imidazo[1,5-a]quinoxalin-4-one is sourced from PubChem (CID 19106539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).