(12-ethyl-2-hydroxy-7-methyl-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl)methyl (2R)-2-methoxypropanoate

C23H24N2O5 — CID 71032210

About (12-ethyl-2-hydroxy-7-methyl-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl)methyl (2R)-2-methoxypropanoate

(12-ethyl-2-hydroxy-7-methyl-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl)methyl (2R)-2-methoxypropanoate (PubChem CID 71032210) has the molecular formula C23H24N2O5 and a molecular weight of 408.45 g/mol. Its IUPAC name is (12-ethyl-2-hydroxy-7-methyl-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl)methyl (2R)-2-methoxypropanoate.

Molecular Properties

• Compound Name: (12-ethyl-2-hydroxy-7-methyl-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl)methyl (2R)-2-methoxypropanoate
• PubChem CID: 71032210
• Molecular Formula: C23H24N2O5
• Molecular Weight: 408.45 g/mol
• Exact Mass: 408.17
• IUPAC Name: (12-ethyl-2-hydroxy-7-methyl-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl)methyl (2R)-2-methoxypropanoate
• SMILES: CCc1c2c(nc3ccc(O)cc13)-c1cc(C)c(COC(=O)[C@@H](C)OC)c(=O)n1C2
• InChI: InChI=1S/C23H24N2O5/c1-5-15-16-9-14(26)6-7-19(16)24-21-17(15)10-25-20(21)8-12(2)18(22(25)27)11-30-23(28)13(3)29-4/h6-9,13,26H,5,10-11H2,1-4H3/t13-/m1/s1
• InChIKey: MYULIPOZVWFYAZ-CYBMUJFWSA-N
• XLogP: 3.08
• TPSA: 90.65 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	408.45
LogP ≤ 5	3.08
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of (12-ethyl-2-hydroxy-7-methyl-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl)methyl (2R)-2-methoxypropanoate?

The IUPAC name of (12-ethyl-2-hydroxy-7-methyl-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl)methyl (2R)-2-methoxypropanoate (CID 71032210) is (12-ethyl-2-hydroxy-7-methyl-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl)methyl (2R)-2-methoxypropanoate.

What is the SMILES notation for (12-ethyl-2-hydroxy-7-methyl-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl)methyl (2R)-2-methoxypropanoate?

The canonical SMILES for (12-ethyl-2-hydroxy-7-methyl-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl)methyl (2R)-2-methoxypropanoate is CCc1c2c(nc3ccc(O)cc13)-c1cc(C)c(COC(=O)[C@@H](C)OC)c(=O)n1C2.

What is the InChIKey of (12-ethyl-2-hydroxy-7-methyl-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl)methyl (2R)-2-methoxypropanoate?

The InChIKey is MYULIPOZVWFYAZ-CYBMUJFWSA-N. The full InChI is InChI=1S/C23H24N2O5/c1-5-15-16-9-14(26)6-7-19(16)24-21-17(15)10-25-20(21)8-12(2)18(22(25)27)11-30-23(28)13(3)29-4/h6-9,13,26H,5,10-11H2,1-4H3/t13-/m1/s1.

What are the key properties of (12-ethyl-2-hydroxy-7-methyl-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl)methyl (2R)-2-methoxypropanoate?

(12-ethyl-2-hydroxy-7-methyl-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl)methyl (2R)-2-methoxypropanoate has a molecular weight of 408.45 g/mol, XLogP of 3.08, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for (12-ethyl-2-hydroxy-7-methyl-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl)methyl (2R)-2-methoxypropanoate is sourced from PubChem (CID 71032210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).