7-fluoro-3-phenyl-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one

C19H16FN3O — CID 10687223

IUPAC7-fluoro-3-phenyl-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one
SMILESCC(C)n1c(=O)c2c(-c3ccccc3)ncn2c2ccc(F)cc21
InChIInChI=1S/C19H16FN3O/c1-12(2)23-16-10-14(20)8-9-15(16)22-11-21-17(18(22)19(23)24)13-6-4-3-5-7-13/h3-12H,1-2H3
InChIKeyAZWSDHHEOBSGGJ-UHFFFAOYSA-N
MW321.36 g/mol
LogP4.04
Rot. Bonds2

About 7-fluoro-3-phenyl-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one

7-fluoro-3-phenyl-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one (PubChem CID 10687223) has the molecular formula C19H16FN3O and a molecular weight of 321.36 g/mol. Its IUPAC name is 7-fluoro-3-phenyl-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one.

Molecular Properties

Compound Name7-fluoro-3-phenyl-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one
PubChem CID10687223
Molecular FormulaC19H16FN3O
Molecular Weight321.36 g/mol
Exact Mass321.13
IUPAC Name7-fluoro-3-phenyl-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one
SMILESCC(C)n1c(=O)c2c(-c3ccccc3)ncn2c2ccc(F)cc21
InChIInChI=1S/C19H16FN3O/c1-12(2)23-16-10-14(20)8-9-15(16)22-11-21-17(18(22)19(23)24)13-6-4-3-5-7-13/h3-12H,1-2H3
InChIKeyAZWSDHHEOBSGGJ-UHFFFAOYSA-N
XLogP4.04
TPSA39.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.36
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4H-Imidazo(4,5-c)quinolin-4-one, 1,5-dihydro-5-butyl-1-methyl-
CID 3077017
[1-(3-Methylphenyl)-5-benzimidazolyl]-(1-piperidinyl)methanone
CID 3243760
KF 18280
CID 3071941
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-3-ethyl-5-phenyl-
CID 3071939
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-3-methyl-5-phenyl-
CID 3071959
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-5-phenyl-3-propyl-
CID 3071969
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-3-(2-methylpropyl)-5-phenyl-
CID 3071971
3-(4-Fluorophenyl)-4,5-dihydro-5-[(pyrrolidino)carbonyl]imidazo[1,5-a]quinoxaline
CID 10570627
(4-cyclopropyl-2,3-dihydroquinoxalin-1-yl)-[3-[(1R)-1-phenylethyl]imidazol-4-yl]methanone
CID 155669602
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-3-(1-methylethyl)-5-phenyl-
CID 3071940
4H-Imidazo(4,5-c)(1,8)naphthyridin-4-one, 3,5-dihydro-5-butyl-3-methyl-
CID 3071975
4H-Imidazo(4,5-c)quinolin-4-one, 1,5-dihydro-5-butyl-1,8-dimethyl-
CID 3077034

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-3-phenyl-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one?
The IUPAC name of 7-fluoro-3-phenyl-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one (CID 10687223) is 7-fluoro-3-phenyl-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one.
What is the SMILES notation for 7-fluoro-3-phenyl-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one?
The canonical SMILES for 7-fluoro-3-phenyl-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one is CC(C)n1c(=O)c2c(-c3ccccc3)ncn2c2ccc(F)cc21.
What is the InChIKey of 7-fluoro-3-phenyl-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one?
The InChIKey is AZWSDHHEOBSGGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3O/c1-12(2)23-16-10-14(20)8-9-15(16)22-11-21-17(18(22)19(23)24)13-6-4-3-5-7-13/h3-12H,1-2H3.
What are the key properties of 7-fluoro-3-phenyl-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one?
7-fluoro-3-phenyl-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one has a molecular weight of 321.36 g/mol, XLogP of 4.04, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-3-phenyl-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one is sourced from PubChem (CID 10687223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).