1-ethyl-4-(4-fluorophenyl)-3-methylimidazo[1,5-a]quinoxaline

C19H16FN3 — CID 102501782

IUPAC1-ethyl-4-(4-fluorophenyl)-3-methylimidazo[1,5-a]quinoxaline
SMILESCCc1nc(C)c2c(-c3ccc(F)cc3)nc3ccccc3n12
InChIInChI=1S/C19H16FN3/c1-3-17-21-12(2)19-18(13-8-10-14(20)11-9-13)22-15-6-4-5-7-16(15)23(17)19/h4-11H,3H2,1-2H3
InChIKeyQHWSIDRRGLLBFE-UHFFFAOYSA-N
MW305.36 g/mol
LogP4.56
Rot. Bonds2

About 1-ethyl-4-(4-fluorophenyl)-3-methylimidazo[1,5-a]quinoxaline

1-ethyl-4-(4-fluorophenyl)-3-methylimidazo[1,5-a]quinoxaline (PubChem CID 102501782) has the molecular formula C19H16FN3 and a molecular weight of 305.36 g/mol. Its IUPAC name is 1-ethyl-4-(4-fluorophenyl)-3-methylimidazo[1,5-a]quinoxaline.

Molecular Properties

Compound Name1-ethyl-4-(4-fluorophenyl)-3-methylimidazo[1,5-a]quinoxaline
PubChem CID102501782
Molecular FormulaC19H16FN3
Molecular Weight305.36 g/mol
Exact Mass305.13
IUPAC Name1-ethyl-4-(4-fluorophenyl)-3-methylimidazo[1,5-a]quinoxaline
SMILESCCc1nc(C)c2c(-c3ccc(F)cc3)nc3ccccc3n12
InChIInChI=1S/C19H16FN3/c1-3-17-21-12(2)19-18(13-8-10-14(20)11-9-13)22-15-6-4-5-7-16(15)23(17)19/h4-11H,3H2,1-2H3
InChIKeyQHWSIDRRGLLBFE-UHFFFAOYSA-N
XLogP4.56
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-bromophenyl)-1-ethyl-3-methylimidazo[1,5-a]quinoxaline
CID 102501781
3,4-dimethyl-1-propylimidazo[1,5-a]quinoxaline
CID 42629095
4-ethyl-2-(4-methylphenyl)-[1,3,5]triazino[1,2-a]benzimidazole
CID 14245741
22-[4-(2-ethylbenzimidazol-1-yl)phenyl]-21-azapentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaene
CID 121475087
1-(3,5-difluorophenyl)-2-ethylbenzimidazole
CID 155179234
S-[4-(4-fluorophenyl)-2,5,7-triazatricyclo[6.5.0.02,6]trideca-1(13),3,5,7,9,11-hexaen-3-yl] propanethioate
CID 14997534
2-(4-fluorophenyl)-1-pentylbenzimidazole
CID 19243184
2-(4-fluorophenyl)-1-hexadecylbenzimidazole
CID 19243176
2-(4-fluorophenyl)-1-hexylbenzimidazole
CID 19243183
1-(4-fluorophenyl)-4-methoxy-[1,2,4]triazolo[4,3-a]quinoxaline
CID 171987938
1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole
CID 95930125
1-benzyl-2-(4-fluorophenyl)benzimidazole
CID 19243195

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-(4-fluorophenyl)-3-methylimidazo[1,5-a]quinoxaline?
The IUPAC name of 1-ethyl-4-(4-fluorophenyl)-3-methylimidazo[1,5-a]quinoxaline (CID 102501782) is 1-ethyl-4-(4-fluorophenyl)-3-methylimidazo[1,5-a]quinoxaline.
What is the SMILES notation for 1-ethyl-4-(4-fluorophenyl)-3-methylimidazo[1,5-a]quinoxaline?
The canonical SMILES for 1-ethyl-4-(4-fluorophenyl)-3-methylimidazo[1,5-a]quinoxaline is CCc1nc(C)c2c(-c3ccc(F)cc3)nc3ccccc3n12.
What is the InChIKey of 1-ethyl-4-(4-fluorophenyl)-3-methylimidazo[1,5-a]quinoxaline?
The InChIKey is QHWSIDRRGLLBFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3/c1-3-17-21-12(2)19-18(13-8-10-14(20)11-9-13)22-15-6-4-5-7-16(15)23(17)19/h4-11H,3H2,1-2H3.
What are the key properties of 1-ethyl-4-(4-fluorophenyl)-3-methylimidazo[1,5-a]quinoxaline?
1-ethyl-4-(4-fluorophenyl)-3-methylimidazo[1,5-a]quinoxaline has a molecular weight of 305.36 g/mol, XLogP of 4.56, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-(4-fluorophenyl)-3-methylimidazo[1,5-a]quinoxaline is sourced from PubChem (CID 102501782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).