3,5-dimethyl-[1,2]oxazolo[4,5-c]quinolin-4-one

C12H10N2O2 — CID 2750999

IUPAC3,5-dimethyl-[1,2]oxazolo[4,5-c]quinolin-4-one
SMILESCc1noc2c1c(=O)n(C)c1ccccc21
InChIInChI=1S/C12H10N2O2/c1-7-10-11(16-13-7)8-5-3-4-6-9(8)14(2)12(10)15/h3-6H,1-2H3
InChIKeyLRLNEVZLVOHEOA-UHFFFAOYSA-N
MW214.22 g/mol
LogP1.99
Rot. Bonds

About 3,5-dimethyl-[1,2]oxazolo[4,5-c]quinolin-4-one

3,5-dimethyl-[1,2]oxazolo[4,5-c]quinolin-4-one (PubChem CID 2750999) has the molecular formula C12H10N2O2 and a molecular weight of 214.22 g/mol. Its IUPAC name is 3,5-dimethyl-[1,2]oxazolo[4,5-c]quinolin-4-one.

Molecular Properties

Compound Name3,5-dimethyl-[1,2]oxazolo[4,5-c]quinolin-4-one
PubChem CID2750999
Molecular FormulaC12H10N2O2
Molecular Weight214.22 g/mol
Exact Mass214.07
IUPAC Name3,5-dimethyl-[1,2]oxazolo[4,5-c]quinolin-4-one
SMILESCc1noc2c1c(=O)n(C)c1ccccc21
InChIInChI=1S/C12H10N2O2/c1-7-10-11(16-13-7)8-5-3-4-6-9(8)14(2)12(10)15/h3-6H,1-2H3
InChIKeyLRLNEVZLVOHEOA-UHFFFAOYSA-N
XLogP1.99
TPSA48.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.22
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-hydroxy-3,6-dimethylpyrano[3,2-c]quinoline-2,5-dione
CID 110273333
5-methyl-[1,2,5]oxadiazolo[3,4-c]quinolin-4-one
CID 2785867
3-ethoxy-5-methyl-[1,2]oxazolo[4,3-c]quinolin-4-one
CID 2786817
5-methyl-1,2-dihydropyrazolo[4,3-c]quinoline-3,4-dione
CID 10242373
3-bromo-4-hydroxy-6-methylpyrano[3,2-c]quinoline-2,5-dione
CID 54718586
3-chloro-1,4-dimethylquinolin-2-one
CID 15643026
3-(3,4-dichlorophenyl)-5-methyl-2-(2-methylanilino)furo[3,2-c]quinolin-4-one
CID 18887715
3-methyl-7,8-diphenylchromeno[3,4-d][1,2]oxazol-4-one
CID 134912057
3-[[3-(4-chlorophenyl)-5-phenyl-1,2-oxazol-4-yl]amino]-5-methyl-2-phenylfuro[3,2-c]quinolin-4-one
CID 177406526
5-methylbenzimidazolo[2,1-b]quinazolin-12-one
CID 13458566
1-(3-chlorophenyl)-3,5-dimethylpyrazolo[4,5-c]quinolin-4-one
CID 2785498
3-iodo-6-methyl-4-phenoxypyrano[3,2-c]quinoline-2,5-dione
CID 2784493

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-[1,2]oxazolo[4,5-c]quinolin-4-one?
The IUPAC name of 3,5-dimethyl-[1,2]oxazolo[4,5-c]quinolin-4-one (CID 2750999) is 3,5-dimethyl-[1,2]oxazolo[4,5-c]quinolin-4-one.
What is the SMILES notation for 3,5-dimethyl-[1,2]oxazolo[4,5-c]quinolin-4-one?
The canonical SMILES for 3,5-dimethyl-[1,2]oxazolo[4,5-c]quinolin-4-one is Cc1noc2c1c(=O)n(C)c1ccccc21.
What is the InChIKey of 3,5-dimethyl-[1,2]oxazolo[4,5-c]quinolin-4-one?
The InChIKey is LRLNEVZLVOHEOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O2/c1-7-10-11(16-13-7)8-5-3-4-6-9(8)14(2)12(10)15/h3-6H,1-2H3.
What are the key properties of 3,5-dimethyl-[1,2]oxazolo[4,5-c]quinolin-4-one?
3,5-dimethyl-[1,2]oxazolo[4,5-c]quinolin-4-one has a molecular weight of 214.22 g/mol, XLogP of 1.99, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-[1,2]oxazolo[4,5-c]quinolin-4-one is sourced from PubChem (CID 2750999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).