6-ethoxy-1-methyl-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one

C14H17N3O2 — CID 21276719

IUPAC6-ethoxy-1-methyl-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one
SMILESCCON1CC2=C(c3cccnc31)C(C)NC(=O)C2
InChIInChI=1S/C14H17N3O2/c1-3-19-17-8-10-7-12(18)16-9(2)13(10)11-5-4-6-15-14(11)17/h4-6,9H,3,7-8H2,1-2H3,(H,16,18)
InChIKeyGUSXJJIZVLEDHU-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.52
Rot. Bonds2

About 6-ethoxy-1-methyl-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one

6-ethoxy-1-methyl-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one (PubChem CID 21276719) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 6-ethoxy-1-methyl-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one.

Molecular Properties

Compound Name6-ethoxy-1-methyl-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one
PubChem CID21276719
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name6-ethoxy-1-methyl-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one
SMILESCCON1CC2=C(c3cccnc31)C(C)NC(=O)C2
InChIInChI=1S/C14H17N3O2/c1-3-19-17-8-10-7-12(18)16-9(2)13(10)11-5-4-6-15-14(11)17/h4-6,9H,3,7-8H2,1-2H3,(H,16,18)
InChIKeyGUSXJJIZVLEDHU-UHFFFAOYSA-N
XLogP1.52
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-propan-2-yl-6-(propylamino)-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one
CID 70386828
6-(ethylamino)-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one
CID 21276756
6-bromo-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one
CID 21276772
3-oxo-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridine-6-carbonitrile
CID 21276739
2-(3-methyl-5-oxopiperazin-1-yl)pyridine-3-carboxamide
CID 172742275
3-methyl-1-(1,3-thiazol-2-ylmethyl)piperazine-2,5-dione
CID 64966359
3-ethyl-1-methyl-3H-pyrrolo[2,3-b]pyridin-2-one
CID 10654865
2-(3-ethoxypiperidin-1-yl)-3-nitropyridine
CID 133274264
2-fluoro-5-[2-(4-methylpiperidin-1-yl)-3-pyridinyl]pyridine
CID 163265991
6-(ethylamino)-1-methyl-4,5-dihydro-2H-pyrido[3,2-c][1,8]naphthyridin-3-one
CID 21276748
3-cyclopropyl-1-[(3-ethyl-2-pyridinyl)methyl]piperazine-2,5-dione
CID 82744928
ethyl 1-(3-nitro-2-pyridinyl)pyrrolidine-2-carboxylate
CID 62004802

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-1-methyl-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one?
The IUPAC name of 6-ethoxy-1-methyl-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one (CID 21276719) is 6-ethoxy-1-methyl-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one.
What is the SMILES notation for 6-ethoxy-1-methyl-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one?
The canonical SMILES for 6-ethoxy-1-methyl-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one is CCON1CC2=C(c3cccnc31)C(C)NC(=O)C2.
What is the InChIKey of 6-ethoxy-1-methyl-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one?
The InChIKey is GUSXJJIZVLEDHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-3-19-17-8-10-7-12(18)16-9(2)13(10)11-5-4-6-15-14(11)17/h4-6,9H,3,7-8H2,1-2H3,(H,16,18).
What are the key properties of 6-ethoxy-1-methyl-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one?
6-ethoxy-1-methyl-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one has a molecular weight of 259.31 g/mol, XLogP of 1.52, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-1-methyl-1,2,4,5-tetrahydropyrido[4,3-c][1,8]naphthyridin-3-one is sourced from PubChem (CID 21276719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).