methyl 3-methyl-4-oxo-5H-furo[3,4-c]quinoline-1-carboxylate

C14H11NO4 — CID 10729818

IUPACmethyl 3-methyl-4-oxo-5H-furo[3,4-c]quinoline-1-carboxylate
SMILESCOC(=O)c1oc(C)c2c(=O)[nH]c3ccccc3c12
InChIInChI=1S/C14H11NO4/c1-7-10-11(12(19-7)14(17)18-2)8-5-3-4-6-9(8)15-13(10)16/h3-6H,1-2H3,(H,15,16)
InChIKeyJVHOSACKYCFQGN-UHFFFAOYSA-N
MW257.24 g/mol
LogP2.37
Rot. Bonds1

About methyl 3-methyl-4-oxo-5H-furo[3,4-c]quinoline-1-carboxylate

methyl 3-methyl-4-oxo-5H-furo[3,4-c]quinoline-1-carboxylate (PubChem CID 10729818) has the molecular formula C14H11NO4 and a molecular weight of 257.24 g/mol. Its IUPAC name is methyl 3-methyl-4-oxo-5H-furo[3,4-c]quinoline-1-carboxylate.

Molecular Properties

Compound Namemethyl 3-methyl-4-oxo-5H-furo[3,4-c]quinoline-1-carboxylate
PubChem CID10729818
Molecular FormulaC14H11NO4
Molecular Weight257.24 g/mol
Exact Mass257.07
IUPAC Namemethyl 3-methyl-4-oxo-5H-furo[3,4-c]quinoline-1-carboxylate
SMILESCOC(=O)c1oc(C)c2c(=O)[nH]c3ccccc3c12
InChIInChI=1S/C14H11NO4/c1-7-10-11(12(19-7)14(17)18-2)8-5-3-4-6-9(8)15-13(10)16/h3-6H,1-2H3,(H,15,16)
InChIKeyJVHOSACKYCFQGN-UHFFFAOYSA-N
XLogP2.37
TPSA72.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.24
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 3-methyl-4-oxo-2,5-dihydropyrrolo[3,4-c]quinoline-1-carboxylate
CID 10634802
methyl 2-methyl-1H-indole-3-carboxylate
CID 594174
dimethyl 4-methyl-9H-carbazole-1,3-dicarboxylate
CID 132503759
ethyl 3-amino-4-oxo-5H-thieno[3,2-c]quinoline-2-carboxylate
CID 11369716
methyl 5-methyl-4-(2-oxo-1H-quinolin-3-yl)furan-2-carboxylate
CID 167783546
methyl 4-methyl-1,5-dioxo-2H-2-benzazepine-3-carboxylate
CID 139182447
methyl 2-oxo-10,21-diazapentacyclo[12.7.0.03,11.04,9.015,20]henicosa-1(14),3(11),4,6,8,12,15,17,19-nonaene-12-carboxylate
CID 10593388
methyl 4-methyl-5H-pyrido[4,3-b]indole-1-carboxylate
CID 13351962
3,22-dimethyl-8,17-diazatetracyclo[16.4.0.02,7.010,15]docosa-1(22),2,4,6,10,12,14,18,20-nonaene-9,16-dione
CID 22971523
methyl 1-pent-4-enoxy-4H-furo[3,4-b]indole-3-carboxylate
CID 102336072
methyl 9H-pyrido[3,4-b]indole-4-carboxylate
CID 11345149
ethane;4-hydroxy-3-methyl-1H-quinolin-2-one
CID 142092755

Frequently Asked Questions

What is the IUPAC name of methyl 3-methyl-4-oxo-5H-furo[3,4-c]quinoline-1-carboxylate?
The IUPAC name of methyl 3-methyl-4-oxo-5H-furo[3,4-c]quinoline-1-carboxylate (CID 10729818) is methyl 3-methyl-4-oxo-5H-furo[3,4-c]quinoline-1-carboxylate.
What is the SMILES notation for methyl 3-methyl-4-oxo-5H-furo[3,4-c]quinoline-1-carboxylate?
The canonical SMILES for methyl 3-methyl-4-oxo-5H-furo[3,4-c]quinoline-1-carboxylate is COC(=O)c1oc(C)c2c(=O)[nH]c3ccccc3c12.
What is the InChIKey of methyl 3-methyl-4-oxo-5H-furo[3,4-c]quinoline-1-carboxylate?
The InChIKey is JVHOSACKYCFQGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NO4/c1-7-10-11(12(19-7)14(17)18-2)8-5-3-4-6-9(8)15-13(10)16/h3-6H,1-2H3,(H,15,16).
What are the key properties of methyl 3-methyl-4-oxo-5H-furo[3,4-c]quinoline-1-carboxylate?
methyl 3-methyl-4-oxo-5H-furo[3,4-c]quinoline-1-carboxylate has a molecular weight of 257.24 g/mol, XLogP of 2.37, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-methyl-4-oxo-5H-furo[3,4-c]quinoline-1-carboxylate is sourced from PubChem (CID 10729818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).