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

C20H15N5O3 — CID 10833139

IUPAC[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxalin-5-yl]-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1Cc2c(-c3noc(C4CC4)n3)ncn2-c2ccccc21
InChIInChI=1S/C20H15N5O3/c26-20(16-6-3-9-27-16)24-10-15-17(18-22-19(28-23-18)12-7-8-12)21-11-25(15)14-5-2-1-4-13(14)24/h1-6,9,11-12H,7-8,10H2
InChIKeyGBGWXODPPMUZDF-UHFFFAOYSA-N
MW373.37 g/mol
LogP3.55
Rot. Bonds3

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

[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxalin-5-yl]-(furan-2-yl)methanone (PubChem CID 10833139) has the molecular formula C20H15N5O3 and a molecular weight of 373.37 g/mol. Its IUPAC name is [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxalin-5-yl]-(furan-2-yl)methanone.

Molecular Properties

Compound Name[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxalin-5-yl]-(furan-2-yl)methanone
PubChem CID10833139
Molecular FormulaC20H15N5O3
Molecular Weight373.37 g/mol
Exact Mass373.12
IUPAC Name[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxalin-5-yl]-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1Cc2c(-c3noc(C4CC4)n3)ncn2-c2ccccc21
InChIInChI=1S/C20H15N5O3/c26-20(16-6-3-9-27-16)24-10-15-17(18-22-19(28-23-18)12-7-8-12)21-11-25(15)14-5-2-1-4-13(14)24/h1-6,9,11-12H,7-8,10H2
InChIKeyGBGWXODPPMUZDF-UHFFFAOYSA-N
XLogP3.55
TPSA90.19 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.37
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxalin-5-yl]-(furan-2-yl)methanone?
The IUPAC name of [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxalin-5-yl]-(furan-2-yl)methanone (CID 10833139) is [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxalin-5-yl]-(furan-2-yl)methanone.
What is the SMILES notation for [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxalin-5-yl]-(furan-2-yl)methanone?
The canonical SMILES for [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxalin-5-yl]-(furan-2-yl)methanone is O=C(c1ccco1)N1Cc2c(-c3noc(C4CC4)n3)ncn2-c2ccccc21.
What is the InChIKey of [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxalin-5-yl]-(furan-2-yl)methanone?
The InChIKey is GBGWXODPPMUZDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N5O3/c26-20(16-6-3-9-27-16)24-10-15-17(18-22-19(28-23-18)12-7-8-12)21-11-25(15)14-5-2-1-4-13(14)24/h1-6,9,11-12H,7-8,10H2.
What are the key properties of [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxalin-5-yl]-(furan-2-yl)methanone?
[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxalin-5-yl]-(furan-2-yl)methanone has a molecular weight of 373.37 g/mol, XLogP of 3.55, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxalin-5-yl]-(furan-2-yl)methanone is sourced from PubChem (CID 10833139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).