2,3-dimethoxy-5,6-dihydroisoquinolino[2,1-b][2,7]naphthyridin-8-one

C18H16N2O3 — CID 11833790

IUPAC2,3-dimethoxy-5,6-dihydroisoquinolino[2,1-b][2,7]naphthyridin-8-one
SMILESCOc1cc2c(cc1OC)-c1cc3ccncc3c(=O)n1CC2
InChIInChI=1S/C18H16N2O3/c1-22-16-8-12-4-6-20-15(13(12)9-17(16)23-2)7-11-3-5-19-10-14(11)18(20)21/h3,5,7-10H,4,6H2,1-2H3
InChIKeyFPLYJGQPGZVKRX-UHFFFAOYSA-N
MW308.34 g/mol
LogP2.64
Rot. Bonds2

About 2,3-dimethoxy-5,6-dihydroisoquinolino[2,1-b][2,7]naphthyridin-8-one

2,3-dimethoxy-5,6-dihydroisoquinolino[2,1-b][2,7]naphthyridin-8-one (PubChem CID 11833790) has the molecular formula C18H16N2O3 and a molecular weight of 308.34 g/mol. Its IUPAC name is 2,3-dimethoxy-5,6-dihydroisoquinolino[2,1-b][2,7]naphthyridin-8-one.

Molecular Properties

Compound Name2,3-dimethoxy-5,6-dihydroisoquinolino[2,1-b][2,7]naphthyridin-8-one
PubChem CID11833790
Molecular FormulaC18H16N2O3
Molecular Weight308.34 g/mol
Exact Mass308.12
IUPAC Name2,3-dimethoxy-5,6-dihydroisoquinolino[2,1-b][2,7]naphthyridin-8-one
SMILESCOc1cc2c(cc1OC)-c1cc3ccncc3c(=O)n1CC2
InChIInChI=1S/C18H16N2O3/c1-22-16-8-12-4-6-20-15(13(12)9-17(16)23-2)7-11-3-5-19-10-14(11)18(20)21/h3,5,7-10H,4,6H2,1-2H3
InChIKeyFPLYJGQPGZVKRX-UHFFFAOYSA-N
XLogP2.64
TPSA53.35 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-hydroxy-2,10,11-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-8-one
CID 46848859
2,3,8-trimethoxy-5,6-dihydroindolo[2,1-a]isoquinoline
CID 45483590
9,10-dimethoxy-2-(2-pyridin-2-yloxyethoxy)-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one
CID 162642975
3-ethyl-2-hydroxy-9,10-dimethoxy-6,7-dihydrobenzo[a]quinolizin-4-one
CID 54705679
2,3,8,9-tetramethoxy-11,12-dihydroquinazolino[3,2-c][3]benzazepine-6,14-dione
CID 12012977
8,9-dimethoxy-5,6-dihydroimidazo[5,1-a]isoquinolin-3-amine
CID 12748079
9,10-dimethoxy-2-(3,4,5-trimethoxyanilino)-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one;hydrochloride
CID 54583747
2-(4-chloroanilino)-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one
CID 2041674
2-(2,3-dimethylphenoxy)-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one
CID 20896181
2-(4-bromoanilino)-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one
CID 2044491
2-chloro-9-ethoxy-10-methoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one
CID 146299674
9,10-dimethoxy-2-(pyridin-2-ylmethylamino)-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one
CID 665278

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethoxy-5,6-dihydroisoquinolino[2,1-b][2,7]naphthyridin-8-one?
The IUPAC name of 2,3-dimethoxy-5,6-dihydroisoquinolino[2,1-b][2,7]naphthyridin-8-one (CID 11833790) is 2,3-dimethoxy-5,6-dihydroisoquinolino[2,1-b][2,7]naphthyridin-8-one.
What is the SMILES notation for 2,3-dimethoxy-5,6-dihydroisoquinolino[2,1-b][2,7]naphthyridin-8-one?
The canonical SMILES for 2,3-dimethoxy-5,6-dihydroisoquinolino[2,1-b][2,7]naphthyridin-8-one is COc1cc2c(cc1OC)-c1cc3ccncc3c(=O)n1CC2.
What is the InChIKey of 2,3-dimethoxy-5,6-dihydroisoquinolino[2,1-b][2,7]naphthyridin-8-one?
The InChIKey is FPLYJGQPGZVKRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O3/c1-22-16-8-12-4-6-20-15(13(12)9-17(16)23-2)7-11-3-5-19-10-14(11)18(20)21/h3,5,7-10H,4,6H2,1-2H3.
What are the key properties of 2,3-dimethoxy-5,6-dihydroisoquinolino[2,1-b][2,7]naphthyridin-8-one?
2,3-dimethoxy-5,6-dihydroisoquinolino[2,1-b][2,7]naphthyridin-8-one has a molecular weight of 308.34 g/mol, XLogP of 2.64, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethoxy-5,6-dihydroisoquinolino[2,1-b][2,7]naphthyridin-8-one is sourced from PubChem (CID 11833790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).