7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-methylphenyl)-3H-imidazo[4,5-c]quinolin-2-one

C22H18N4O2 — CID 52933810

IUPAC7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-methylphenyl)-3H-imidazo[4,5-c]quinolin-2-one
SMILESCc1ccccc1-n1c(=O)[nH]c2cnc3cc(-c4c(C)noc4C)ccc3c21
InChIInChI=1S/C22H18N4O2/c1-12-6-4-5-7-19(12)26-21-16-9-8-15(20-13(2)25-28-14(20)3)10-17(16)23-11-18(21)24-22(26)27/h4-11H,1-3H3,(H,24,27)
InChIKeyNZVHYKKOMPPAIM-UHFFFAOYSA-N
MW370.41 g/mol
LogP4.45
Rot. Bonds2

About 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-methylphenyl)-3H-imidazo[4,5-c]quinolin-2-one

7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-methylphenyl)-3H-imidazo[4,5-c]quinolin-2-one (PubChem CID 52933810) has the molecular formula C22H18N4O2 and a molecular weight of 370.41 g/mol. Its IUPAC name is 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-methylphenyl)-3H-imidazo[4,5-c]quinolin-2-one.

Molecular Properties

Compound Name7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-methylphenyl)-3H-imidazo[4,5-c]quinolin-2-one
PubChem CID52933810
Molecular FormulaC22H18N4O2
Molecular Weight370.41 g/mol
Exact Mass370.14
IUPAC Name7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-methylphenyl)-3H-imidazo[4,5-c]quinolin-2-one
SMILESCc1ccccc1-n1c(=O)[nH]c2cnc3cc(-c4c(C)noc4C)ccc3c21
InChIInChI=1S/C22H18N4O2/c1-12-6-4-5-7-19(12)26-21-16-9-8-15(20-13(2)25-28-14(20)3)10-17(16)23-11-18(21)24-22(26)27/h4-11H,1-3H3,(H,24,27)
InChIKeyNZVHYKKOMPPAIM-UHFFFAOYSA-N
XLogP4.45
TPSA76.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-methylphenyl)-3H-imidazo[4,5-c]quinolin-2-one?
The IUPAC name of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-methylphenyl)-3H-imidazo[4,5-c]quinolin-2-one (CID 52933810) is 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-methylphenyl)-3H-imidazo[4,5-c]quinolin-2-one.
What is the SMILES notation for 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-methylphenyl)-3H-imidazo[4,5-c]quinolin-2-one?
The canonical SMILES for 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-methylphenyl)-3H-imidazo[4,5-c]quinolin-2-one is Cc1ccccc1-n1c(=O)[nH]c2cnc3cc(-c4c(C)noc4C)ccc3c21.
What is the InChIKey of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-methylphenyl)-3H-imidazo[4,5-c]quinolin-2-one?
The InChIKey is NZVHYKKOMPPAIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O2/c1-12-6-4-5-7-19(12)26-21-16-9-8-15(20-13(2)25-28-14(20)3)10-17(16)23-11-18(21)24-22(26)27/h4-11H,1-3H3,(H,24,27).
What are the key properties of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-methylphenyl)-3H-imidazo[4,5-c]quinolin-2-one?
7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-methylphenyl)-3H-imidazo[4,5-c]quinolin-2-one has a molecular weight of 370.41 g/mol, XLogP of 4.45, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-methylphenyl)-3H-imidazo[4,5-c]quinolin-2-one is sourced from PubChem (CID 52933810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).