methyl 3-methoxy-1-methyl-2,10-dioxo-5,6-dihydropyrido[1,2-h][1,7]naphthyridine-9-carboxylate

C16H16N2O5 — CID 142344178

IUPACmethyl 3-methoxy-1-methyl-2,10-dioxo-5,6-dihydropyrido[1,2-h][1,7]naphthyridine-9-carboxylate
SMILESCOC(=O)c1cn2c(cc1=O)-c1c(cc(OC)c(=O)n1C)CC2
InChIInChI=1S/C16H16N2O5/c1-17-14-9(6-13(22-2)15(17)20)4-5-18-8-10(16(21)23-3)12(19)7-11(14)18/h6-8H,4-5H2,1-3H3
InChIKeyLMAIKWWFMOBSFQ-UHFFFAOYSA-N
MW316.31 g/mol
LogP0.57
Rot. Bonds2

About methyl 3-methoxy-1-methyl-2,10-dioxo-5,6-dihydropyrido[1,2-h][1,7]naphthyridine-9-carboxylate

methyl 3-methoxy-1-methyl-2,10-dioxo-5,6-dihydropyrido[1,2-h][1,7]naphthyridine-9-carboxylate (PubChem CID 142344178) has the molecular formula C16H16N2O5 and a molecular weight of 316.31 g/mol. Its IUPAC name is methyl 3-methoxy-1-methyl-2,10-dioxo-5,6-dihydropyrido[1,2-h][1,7]naphthyridine-9-carboxylate.

Molecular Properties

Compound Namemethyl 3-methoxy-1-methyl-2,10-dioxo-5,6-dihydropyrido[1,2-h][1,7]naphthyridine-9-carboxylate
PubChem CID142344178
Molecular FormulaC16H16N2O5
Molecular Weight316.31 g/mol
Exact Mass316.11
IUPAC Namemethyl 3-methoxy-1-methyl-2,10-dioxo-5,6-dihydropyrido[1,2-h][1,7]naphthyridine-9-carboxylate
SMILESCOC(=O)c1cn2c(cc1=O)-c1c(cc(OC)c(=O)n1C)CC2
InChIInChI=1S/C16H16N2O5/c1-17-14-9(6-13(22-2)15(17)20)4-5-18-8-10(16(21)23-3)12(19)7-11(14)18/h6-8H,4-5H2,1-3H3
InChIKeyLMAIKWWFMOBSFQ-UHFFFAOYSA-N
XLogP0.57
TPSA79.53 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.31
LogP ≤ 50.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze methyl 3-methoxy-1-methyl-2,10-dioxo-5,6-dihydropyrido[1,2-h][1,7]naphthyridine-9-carboxylate with MolForge

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Related Compounds

methyl (6S)-3-methoxy-1-methyl-2,10-dioxo-6-propan-2-yl-5,6-dihydropyrido[1,2-h][1,7]naphthyridine-9-carboxylate
CID 142755159
ethane;ethyl 10-methoxy-9-[(3-methoxycyclobutyl)methoxy]-2-oxo-6,7-dihydrobenzo[a]quinolizine-3-carboxylate;propane
CID 145449973
methyl 3-(3,5-dimethylphenyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-2-carboxylate
CID 89464199
10-methoxy-9-[[3-(methoxymethyl)oxetan-3-yl]methoxy]-2-oxo-6,7-dihydrobenzo[a]quinolizine-3-carboxylic acid
CID 138692243
2-oxo-9,10-dipropoxy-6,7-dihydrobenzo[a]quinolizine-3-carboxylic acid
CID 118251775
9-[3-(4-carboxyphenyl)propoxy]-10-methoxy-2-oxo-6,7-dihydrobenzo[a]quinolizine-3-carboxylic acid
CID 170602227
methyl 2-methoxy-5-(4-methylpiperazin-1-yl)benzoate
CID 176816359
methyl 2-methoxy-4-(4-methylpiperazin-1-yl)benzoate
CID 66996253
ethyl 6-hydroxy-14-oxo-4,8-dioxa-17-azatetracyclo[9.8.0.03,9.012,17]nonadeca-1,3(9),10,12,15-pentaene-15-carboxylate
CID 146180911
9-(3-methoxypropoxy)-2-oxo-10-pyrrolidin-1-yl-6,7-dihydrobenzo[a]quinolizine-3-carboxylic acid
CID 139336264
6-methoxy-14-oxo-4,8-dioxa-17-azatetracyclo[9.8.0.03,9.012,17]nonadeca-1,3(9),10,12,15-pentaene-15-carboxylic acid
CID 146180846
methyl 11-oxo-5,6-dihydropyrrolo[1,2-c][3]benzazepine-2-carboxylate
CID 13152889

Frequently Asked Questions

What is the IUPAC name of methyl 3-methoxy-1-methyl-2,10-dioxo-5,6-dihydropyrido[1,2-h][1,7]naphthyridine-9-carboxylate?
The IUPAC name of methyl 3-methoxy-1-methyl-2,10-dioxo-5,6-dihydropyrido[1,2-h][1,7]naphthyridine-9-carboxylate (CID 142344178) is methyl 3-methoxy-1-methyl-2,10-dioxo-5,6-dihydropyrido[1,2-h][1,7]naphthyridine-9-carboxylate.
What is the SMILES notation for methyl 3-methoxy-1-methyl-2,10-dioxo-5,6-dihydropyrido[1,2-h][1,7]naphthyridine-9-carboxylate?
The canonical SMILES for methyl 3-methoxy-1-methyl-2,10-dioxo-5,6-dihydropyrido[1,2-h][1,7]naphthyridine-9-carboxylate is COC(=O)c1cn2c(cc1=O)-c1c(cc(OC)c(=O)n1C)CC2.
What is the InChIKey of methyl 3-methoxy-1-methyl-2,10-dioxo-5,6-dihydropyrido[1,2-h][1,7]naphthyridine-9-carboxylate?
The InChIKey is LMAIKWWFMOBSFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O5/c1-17-14-9(6-13(22-2)15(17)20)4-5-18-8-10(16(21)23-3)12(19)7-11(14)18/h6-8H,4-5H2,1-3H3.
What are the key properties of methyl 3-methoxy-1-methyl-2,10-dioxo-5,6-dihydropyrido[1,2-h][1,7]naphthyridine-9-carboxylate?
methyl 3-methoxy-1-methyl-2,10-dioxo-5,6-dihydropyrido[1,2-h][1,7]naphthyridine-9-carboxylate has a molecular weight of 316.31 g/mol, XLogP of 0.57, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-methoxy-1-methyl-2,10-dioxo-5,6-dihydropyrido[1,2-h][1,7]naphthyridine-9-carboxylate is sourced from PubChem (CID 142344178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).