[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-imidazol-1-ylmethanone

C19H14FN7O2 — CID 22912860

IUPAC[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-imidazol-1-ylmethanone
SMILESO=C(N1Cc2c(-c3noc(C4CC4)n3)ncn2-c2ccc(F)cc21)n1ccnc1
InChIInChI=1S/C19H14FN7O2/c20-12-3-4-13-14(7-12)26(19(28)25-6-5-21-9-25)8-15-16(22-10-27(13)15)17-23-18(29-24-17)11-1-2-11/h3-7,9-11H,1-2,8H2
InChIKeyJOPOOWVNIUVGLE-UHFFFAOYSA-N
MW391.37 g/mol
LogP3.12
Rot. Bonds2

About [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-imidazol-1-ylmethanone

[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-imidazol-1-ylmethanone (PubChem CID 22912860) has the molecular formula C19H14FN7O2 and a molecular weight of 391.37 g/mol. Its IUPAC name is [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-imidazol-1-ylmethanone.

Molecular Properties

Compound Name[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-imidazol-1-ylmethanone
PubChem CID22912860
Molecular FormulaC19H14FN7O2
Molecular Weight391.37 g/mol
Exact Mass391.12
IUPAC Name[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-imidazol-1-ylmethanone
SMILESO=C(N1Cc2c(-c3noc(C4CC4)n3)ncn2-c2ccc(F)cc21)n1ccnc1
InChIInChI=1S/C19H14FN7O2/c20-12-3-4-13-14(7-12)26(19(28)25-6-5-21-9-25)8-15-16(22-10-27(13)15)17-23-18(29-24-17)11-1-2-11/h3-7,9-11H,1-2,8H2
InChIKeyJOPOOWVNIUVGLE-UHFFFAOYSA-N
XLogP3.12
TPSA94.87 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.37
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-imidazol-1-ylmethanone with MolForge

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Related Compounds

3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxaline-5-carbonyl chloride
CID 10570476
3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxaline-5-carboxamide
CID 10519853
[7-chloro-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxalin-5-yl]-phenylmethanone
CID 22912904
2-[(4R)-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4-methyl-4H-imidazo[1,5-a]quinoxalin-5-yl]-1-pyrrolidin-1-ylethanone
CID 139878714
3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-N-methoxy-4H-imidazo[1,5-a]quinoxaline-5-carboxamide
CID 15268196
[6-chloro-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxalin-5-yl]-pyrrolidin-1-ylmethanone
CID 10501746
7-bromo-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one
CID 10340921
5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-10-methoxy-2,4,8,10-tetrazatetracyclo[6.6.1.02,6.011,15]pentadeca-1(14),3,5,11(15),12-pentaen-9-one
CID 15268199
[3-(1,3-benzoxazol-2-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-pyrrolidin-1-ylmethanone
CID 22912965
3-(14-chloro-2,4,8,9,11-pentazatetracyclo[11.4.0.02,6.08,12]heptadeca-1(13),3,5,9,11,14,16-heptaen-5-yl)-5-cyclopropyl-1,2,4-oxadiazole
CID 10316796
[4-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-pyridinyl]piperazin-1-yl]-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]methanone
CID 90491474
7-chloro-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one;6-chloro-4-methyl-1,3-dihydro-1,4-benzodiazepine-2,5-dione
CID 157329052

Frequently Asked Questions

What is the IUPAC name of [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-imidazol-1-ylmethanone?
The IUPAC name of [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-imidazol-1-ylmethanone (CID 22912860) is [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-imidazol-1-ylmethanone.
What is the SMILES notation for [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-imidazol-1-ylmethanone?
The canonical SMILES for [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-imidazol-1-ylmethanone is O=C(N1Cc2c(-c3noc(C4CC4)n3)ncn2-c2ccc(F)cc21)n1ccnc1.
What is the InChIKey of [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-imidazol-1-ylmethanone?
The InChIKey is JOPOOWVNIUVGLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FN7O2/c20-12-3-4-13-14(7-12)26(19(28)25-6-5-21-9-25)8-15-16(22-10-27(13)15)17-23-18(29-24-17)11-1-2-11/h3-7,9-11H,1-2,8H2.
What are the key properties of [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-imidazol-1-ylmethanone?
[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-imidazol-1-ylmethanone has a molecular weight of 391.37 g/mol, XLogP of 3.12, 2 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-imidazol-1-ylmethanone is sourced from PubChem (CID 22912860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).