methyl 2-methoxy-1,5-dioxopyrrolo[1,2-a]quinoline-4-carboxylate

C15H11NO5 — CID 162983908

IUPACmethyl 2-methoxy-1,5-dioxopyrrolo[1,2-a]quinoline-4-carboxylate
SMILESCOC(=O)c1c2n(c3ccccc3c1=O)C(=O)C(OC)=C2
InChIInChI=1S/C15H11NO5/c1-20-11-7-10-12(15(19)21-2)13(17)8-5-3-4-6-9(8)16(10)14(11)18/h3-7H,1-2H3
InChIKeyWITUJUHQHMMCAH-UHFFFAOYSA-N
MW285.26 g/mol
LogP1.43
Rot. Bonds2

About methyl 2-methoxy-1,5-dioxopyrrolo[1,2-a]quinoline-4-carboxylate

methyl 2-methoxy-1,5-dioxopyrrolo[1,2-a]quinoline-4-carboxylate (PubChem CID 162983908) has the molecular formula C15H11NO5 and a molecular weight of 285.26 g/mol. Its IUPAC name is methyl 2-methoxy-1,5-dioxopyrrolo[1,2-a]quinoline-4-carboxylate.

Molecular Properties

Compound Namemethyl 2-methoxy-1,5-dioxopyrrolo[1,2-a]quinoline-4-carboxylate
PubChem CID162983908
Molecular FormulaC15H11NO5
Molecular Weight285.26 g/mol
Exact Mass285.06
IUPAC Namemethyl 2-methoxy-1,5-dioxopyrrolo[1,2-a]quinoline-4-carboxylate
SMILESCOC(=O)c1c2n(c3ccccc3c1=O)C(=O)C(OC)=C2
InChIInChI=1S/C15H11NO5/c1-20-11-7-10-12(15(19)21-2)13(17)8-5-3-4-6-9(8)16(10)14(11)18/h3-7H,1-2H3
InChIKeyWITUJUHQHMMCAH-UHFFFAOYSA-N
XLogP1.43
TPSA74.60 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.26
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

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CID 139057809
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CID 23239285
methyl 9-phenylcarbazole-3-carboxylate
CID 164892004
methyl 2-(1-methoxy-2-methyl-4-oxoquinolin-3-yl)-2-oxoacetate
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3-benzoyl-1-(4-methoxyphenyl)-2-phenylquinolin-4-one
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methyl 14-azahexacyclo[12.10.1.02,7.08,13.015,20.021,25]pentacosa-1(24),2,4,6,8(13),9,11,15,17,19,21(25),22-dodecaene-11-carboxylate
CID 121386131
methyl 3-carbazol-9-ylthiophene-2-carboxylate
CID 70982066
methyl 1-methyl-2-propylindole-3-carboxylate
CID 102080307
methyl 2-(1-hydroxyethyl)-1-methylindole-3-carboxylate
CID 10704781
methyl 6-hydroxy-2-methyl-5-oxopyridazino[3,4-c]quinoline-1-carboxylate
CID 10517236
dimethyl picene-13,14-dicarboxylate
CID 101053496

Frequently Asked Questions

What is the IUPAC name of methyl 2-methoxy-1,5-dioxopyrrolo[1,2-a]quinoline-4-carboxylate?
The IUPAC name of methyl 2-methoxy-1,5-dioxopyrrolo[1,2-a]quinoline-4-carboxylate (CID 162983908) is methyl 2-methoxy-1,5-dioxopyrrolo[1,2-a]quinoline-4-carboxylate.
What is the SMILES notation for methyl 2-methoxy-1,5-dioxopyrrolo[1,2-a]quinoline-4-carboxylate?
The canonical SMILES for methyl 2-methoxy-1,5-dioxopyrrolo[1,2-a]quinoline-4-carboxylate is COC(=O)c1c2n(c3ccccc3c1=O)C(=O)C(OC)=C2.
What is the InChIKey of methyl 2-methoxy-1,5-dioxopyrrolo[1,2-a]quinoline-4-carboxylate?
The InChIKey is WITUJUHQHMMCAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11NO5/c1-20-11-7-10-12(15(19)21-2)13(17)8-5-3-4-6-9(8)16(10)14(11)18/h3-7H,1-2H3.
What are the key properties of methyl 2-methoxy-1,5-dioxopyrrolo[1,2-a]quinoline-4-carboxylate?
methyl 2-methoxy-1,5-dioxopyrrolo[1,2-a]quinoline-4-carboxylate has a molecular weight of 285.26 g/mol, XLogP of 1.43, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methoxy-1,5-dioxopyrrolo[1,2-a]quinoline-4-carboxylate is sourced from PubChem (CID 162983908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).