7-fluoro-4-methyl-3-[5-(2-methylcyclopropyl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one

C17H15FN6O — CID 67887806

IUPAC7-fluoro-4-methyl-3-[5-(2-methylcyclopropyl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one
SMILESCC1CC1c1cnnn1-c1ncn2c3ccc(F)cc3c(=O)n(C)c12
InChIInChI=1S/C17H15FN6O/c1-9-5-11(9)14-7-20-21-24(14)15-16-22(2)17(25)12-6-10(18)3-4-13(12)23(16)8-19-15/h3-4,6-9,11H,5H2,1-2H3
InChIKeyZKEUUHRBPNJJNT-UHFFFAOYSA-N
MW338.35 g/mol
LogP2.03
Rot. Bonds2

About 7-fluoro-4-methyl-3-[5-(2-methylcyclopropyl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one

7-fluoro-4-methyl-3-[5-(2-methylcyclopropyl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one (PubChem CID 67887806) has the molecular formula C17H15FN6O and a molecular weight of 338.35 g/mol. Its IUPAC name is 7-fluoro-4-methyl-3-[5-(2-methylcyclopropyl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one.

Molecular Properties

Compound Name7-fluoro-4-methyl-3-[5-(2-methylcyclopropyl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one
PubChem CID67887806
Molecular FormulaC17H15FN6O
Molecular Weight338.35 g/mol
Exact Mass338.13
IUPAC Name7-fluoro-4-methyl-3-[5-(2-methylcyclopropyl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one
SMILESCC1CC1c1cnnn1-c1ncn2c3ccc(F)cc3c(=O)n(C)c12
InChIInChI=1S/C17H15FN6O/c1-9-5-11(9)14-7-20-21-24(14)15-16-22(2)17(25)12-6-10(18)3-4-13(12)23(16)8-19-15/h3-4,6-9,11H,5H2,1-2H3
InChIKeyZKEUUHRBPNJJNT-UHFFFAOYSA-N
XLogP2.03
TPSA70.01 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.35
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 7-fluoro-4-methyl-3-[5-(2-methylcyclopropyl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one with MolForge

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Related Compounds

3-[4-(bromomethyl)triazol-1-yl]-7-fluoro-4-methylimidazo[1,5-a]quinazolin-5-one
CID 67889411
7-fluoro-3-[4-[(1-hydroxycyclopropyl)methyl]triazol-1-yl]-4-methylimidazo[1,5-a]quinazolin-5-one
CID 56613115
7-fluoro-4-methyl-3-[4-(oxolan-3-yl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one
CID 67886636
7-fluoro-4-methyl-3-[4-(oxolan-2-ylmethyl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one
CID 67886082
3-(5-tert-butyltriazol-1-yl)-6-fluoro-4-methylimidazo[1,5-a]quinazolin-5-one
CID 56629982
3-(5-cyclopropyltriazol-1-yl)-7-fluoro-5-(oxan-2-ylmethyl)imidazo[1,5-a]quinoxalin-4-one
CID 67889479
3-(4-cyclopropyltriazol-1-yl)-4-methylimidazo[1,5-a]quinazolin-5-one
CID 67886911
ethyl 7-chloro-4-methyl-5-oxoimidazo[1,5-a]quinazoline-3-carboxylate
CID 44561388
5-(2-methoxyethyl)-3-[5-(1-methylpyrrolidin-2-yl)triazol-1-yl]imidazo[1,5-a]quinoxalin-4-one
CID 67886474
6-fluoro-1,4-dimethylquinolin-2-one
CID 90037108
3-[5-(1-acetylpyrrolidin-2-yl)triazol-1-yl]-5-propan-2-ylimidazo[1,5-a]quinoxalin-4-one
CID 67887449
7-fluoro-5-(2-methoxyethyl)-3-[3-(2-methylcyclopropyl)-1,2,4-oxadiazol-5-yl]imidazo[1,5-a]quinoxalin-4-one
CID 56635421

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-4-methyl-3-[5-(2-methylcyclopropyl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one?
The IUPAC name of 7-fluoro-4-methyl-3-[5-(2-methylcyclopropyl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one (CID 67887806) is 7-fluoro-4-methyl-3-[5-(2-methylcyclopropyl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one.
What is the SMILES notation for 7-fluoro-4-methyl-3-[5-(2-methylcyclopropyl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one?
The canonical SMILES for 7-fluoro-4-methyl-3-[5-(2-methylcyclopropyl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one is CC1CC1c1cnnn1-c1ncn2c3ccc(F)cc3c(=O)n(C)c12.
What is the InChIKey of 7-fluoro-4-methyl-3-[5-(2-methylcyclopropyl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one?
The InChIKey is ZKEUUHRBPNJJNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN6O/c1-9-5-11(9)14-7-20-21-24(14)15-16-22(2)17(25)12-6-10(18)3-4-13(12)23(16)8-19-15/h3-4,6-9,11H,5H2,1-2H3.
What are the key properties of 7-fluoro-4-methyl-3-[5-(2-methylcyclopropyl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one?
7-fluoro-4-methyl-3-[5-(2-methylcyclopropyl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one has a molecular weight of 338.35 g/mol, XLogP of 2.03, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-4-methyl-3-[5-(2-methylcyclopropyl)triazol-1-yl]imidazo[1,5-a]quinazolin-5-one is sourced from PubChem (CID 67887806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).