3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-N,N-dimethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide

C18H17FN6O2 — CID 10690367

IUPAC3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-N,N-dimethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide
SMILESCN(C)C(=O)N1Cc2c(-c3noc(C4CC4)n3)ncn2-c2ccc(F)cc21
InChIInChI=1S/C18H17FN6O2/c1-23(2)18(26)24-8-14-15(16-21-17(27-22-16)10-3-4-10)20-9-25(14)12-6-5-11(19)7-13(12)24/h5-7,9-10H,3-4,8H2,1-2H3
InChIKeyHWYBGTRXMBUJAW-UHFFFAOYSA-N
MW368.37 g/mol
LogP2.94
Rot. Bonds2

About 3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-N,N-dimethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide

3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-N,N-dimethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide (PubChem CID 10690367) has the molecular formula C18H17FN6O2 and a molecular weight of 368.37 g/mol. Its IUPAC name is 3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-N,N-dimethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide.

Molecular Properties

Compound Name3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-N,N-dimethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide
PubChem CID10690367
Molecular FormulaC18H17FN6O2
Molecular Weight368.37 g/mol
Exact Mass368.14
IUPAC Name3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-N,N-dimethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide
SMILESCN(C)C(=O)N1Cc2c(-c3noc(C4CC4)n3)ncn2-c2ccc(F)cc21
InChIInChI=1S/C18H17FN6O2/c1-23(2)18(26)24-8-14-15(16-21-17(27-22-16)10-3-4-10)20-9-25(14)12-6-5-11(19)7-13(12)24/h5-7,9-10H,3-4,8H2,1-2H3
InChIKeyHWYBGTRXMBUJAW-UHFFFAOYSA-N
XLogP2.94
TPSA80.29 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.37
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-N,N-dimethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide with MolForge

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Related Compounds

Panadiplon
CID 3033821
5-(5-Cyclopropyl-1,2,4-oxadiazol-3-yl)-2,4,11-triazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),3,5,12,14-pentaen-10-one
CID 9840599
[3-(5-Cyclopropyl-[1,2,4]oxadiazol-3-yl)-4H-imidazo[1,5-a]quinoxalin-5-yl]-phenyl-methanone
CID 9800173
Methyl 3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4,4-dimethylimidazo[1,5-a]quinoxaline-5-carboxylate
CID 10067398
3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-N,N-diethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide
CID 10091056
1-[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]ethanone
CID 10337249
(7S)-5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,4,11-triazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),3,5,12,14-pentaen-10-one
CID 10359467
3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-N,N-dimethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide
CID 10360506
(7R)-5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2,4,11-triazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),3,5,12,14-pentaen-10-one
CID 10382158
5-Benzoyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-fluoro-4,5-dihydroimidazo[1,5-a]quinoxaline
CID 10431153
5-Acetyl-3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-6-fluoro-4,5-dihydroimidazo[1,5-a]quinoxaline
CID 10449849
[3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-4H-imidazo[1,5-a]quinoxalin-5-yl]-pyrrolidin-1-ylmethanone
CID 10500819

Frequently Asked Questions

What is the IUPAC name of 3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-N,N-dimethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide?
The IUPAC name of 3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-N,N-dimethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide (CID 10690367) is 3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-N,N-dimethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide.
What is the SMILES notation for 3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-N,N-dimethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide?
The canonical SMILES for 3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-N,N-dimethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide is CN(C)C(=O)N1Cc2c(-c3noc(C4CC4)n3)ncn2-c2ccc(F)cc21.
What is the InChIKey of 3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-N,N-dimethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide?
The InChIKey is HWYBGTRXMBUJAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN6O2/c1-23(2)18(26)24-8-14-15(16-21-17(27-22-16)10-3-4-10)20-9-25(14)12-6-5-11(19)7-13(12)24/h5-7,9-10H,3-4,8H2,1-2H3.
What are the key properties of 3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-N,N-dimethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide?
3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-N,N-dimethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide has a molecular weight of 368.37 g/mol, XLogP of 2.94, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-7-fluoro-N,N-dimethyl-4H-imidazo[1,5-a]quinoxaline-5-carboxamide is sourced from PubChem (CID 10690367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).