7-fluoro-5-(2-morpholin-4-ylethyl)-4-oxo-3-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile

C23H22FN7O4 — CID 67888144

IUPAC7-fluoro-5-(2-morpholin-4-ylethyl)-4-oxo-3-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile
SMILESN#Cc1c(F)ccc2c1n(CCN1CCOCC1)c(=O)c1c(-c3nc(C4CCOC4)no3)ncn12
InChIInChI=1S/C23H22FN7O4/c24-16-1-2-17-19(15(16)11-25)30(5-4-29-6-9-33-10-7-29)23(32)20-18(26-13-31(17)20)22-27-21(28-35-22)14-3-8-34-12-14/h1-2,13-14H,3-10,12H2
InChIKeyAHXMBQDKVPNYMC-UHFFFAOYSA-N
MW479.47 g/mol
LogP1.55
Rot. Bonds5

About 7-fluoro-5-(2-morpholin-4-ylethyl)-4-oxo-3-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile

7-fluoro-5-(2-morpholin-4-ylethyl)-4-oxo-3-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile (PubChem CID 67888144) has the molecular formula C23H22FN7O4 and a molecular weight of 479.47 g/mol. Its IUPAC name is 7-fluoro-5-(2-morpholin-4-ylethyl)-4-oxo-3-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile.

Molecular Properties

Compound Name7-fluoro-5-(2-morpholin-4-ylethyl)-4-oxo-3-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile
PubChem CID67888144
Molecular FormulaC23H22FN7O4
Molecular Weight479.47 g/mol
Exact Mass479.17
IUPAC Name7-fluoro-5-(2-morpholin-4-ylethyl)-4-oxo-3-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile
SMILESN#Cc1c(F)ccc2c1n(CCN1CCOCC1)c(=O)c1c(-c3nc(C4CCOC4)no3)ncn12
InChIInChI=1S/C23H22FN7O4/c24-16-1-2-17-19(15(16)11-25)30(5-4-29-6-9-33-10-7-29)23(32)20-18(26-13-31(17)20)22-27-21(28-35-22)14-3-8-34-12-14/h1-2,13-14H,3-10,12H2
InChIKeyAHXMBQDKVPNYMC-UHFFFAOYSA-N
XLogP1.55
TPSA123.71 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500479.47
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 7-fluoro-5-(2-morpholin-4-ylethyl)-4-oxo-3-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(2-morpholin-4-ylethyl)-3-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxalin-4-one
CID 67887527
7-chloro-5-(2-morpholin-4-ylethyl)-4-oxo-3-[3-(oxolan-2-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile
CID 67889132
3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-7-fluoro-4-oxo-5-(pyridin-2-ylmethyl)imidazo[1,5-a]quinoxaline-6-carbonitrile
CID 67888172
7-fluoro-3-[5-(1-hydroxypropan-2-yl)-1,2,4-oxadiazol-3-yl]-5-(2-morpholin-4-ylethyl)-4-oxoimidazo[1,5-a]quinoxaline-6-carbonitrile
CID 67888335
7-chloro-3-[3-(1-hydroxycyclopropyl)-1,2,4-oxadiazol-5-yl]-5-(2-morpholin-4-ylethyl)-4-oxoimidazo[1,5-a]quinoxaline-6-carbonitrile
CID 67886730
7-fluoro-5-[2-(4-hydroxypiperidin-1-yl)ethyl]-3-[5-(2-hydroxypropan-2-yl)-1,2,4-oxadiazol-3-yl]-4-oxoimidazo[1,5-a]quinoxaline-6-carbonitrile
CID 67889189
7-fluoro-5-[2-(4-hydroxypiperidin-1-yl)ethyl]-4-oxo-3-[5-(oxolan-2-yl)-1,2,4-oxadiazol-3-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile
CID 67889767
7-fluoro-5-[2-(4-hydroxypiperidin-1-yl)ethyl]-3-[5-(2-methoxypropan-2-yl)-1,2,4-oxadiazol-3-yl]-4-oxoimidazo[1,5-a]quinoxaline-6-carbonitrile
CID 67889658
7-chloro-5-[2-(3-hydroxypiperidin-1-yl)ethyl]-4-oxo-3-[5-(oxolan-3-yl)-1,2,4-oxadiazol-3-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile
CID 67889542
6-fluoro-3-[3-(5-methylfuran-2-yl)-1,2,4-oxadiazol-5-yl]-5-(2-morpholin-4-ylethyl)imidazo[1,5-a]quinoxalin-4-one
CID 67886891
3-(5-cyclopentyl-1,2,4-oxadiazol-3-yl)-7-fluoro-5-(2-methoxyethyl)-4-oxoimidazo[1,5-a]quinoxaline-6-carbonitrile
CID 67889497
7-fluoro-5-[2-(3-hydroxypiperidin-1-yl)ethyl]-3-[5-(2-methylcyclopropyl)-1,2,4-oxadiazol-3-yl]-4-oxoimidazo[1,5-a]quinoxaline-6-carbonitrile
CID 67888722

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-5-(2-morpholin-4-ylethyl)-4-oxo-3-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile?
The IUPAC name of 7-fluoro-5-(2-morpholin-4-ylethyl)-4-oxo-3-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile (CID 67888144) is 7-fluoro-5-(2-morpholin-4-ylethyl)-4-oxo-3-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile.
What is the SMILES notation for 7-fluoro-5-(2-morpholin-4-ylethyl)-4-oxo-3-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile?
The canonical SMILES for 7-fluoro-5-(2-morpholin-4-ylethyl)-4-oxo-3-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile is N#Cc1c(F)ccc2c1n(CCN1CCOCC1)c(=O)c1c(-c3nc(C4CCOC4)no3)ncn12.
What is the InChIKey of 7-fluoro-5-(2-morpholin-4-ylethyl)-4-oxo-3-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile?
The InChIKey is AHXMBQDKVPNYMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22FN7O4/c24-16-1-2-17-19(15(16)11-25)30(5-4-29-6-9-33-10-7-29)23(32)20-18(26-13-31(17)20)22-27-21(28-35-22)14-3-8-34-12-14/h1-2,13-14H,3-10,12H2.
What are the key properties of 7-fluoro-5-(2-morpholin-4-ylethyl)-4-oxo-3-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile?
7-fluoro-5-(2-morpholin-4-ylethyl)-4-oxo-3-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile has a molecular weight of 479.47 g/mol, XLogP of 1.55, 5 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-5-(2-morpholin-4-ylethyl)-4-oxo-3-[3-(oxolan-3-yl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxaline-6-carbonitrile is sourced from PubChem (CID 67888144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).