7-(1,3,4-oxadiazol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one

C19H11N5O2 — CID 137437968

IUPAC7-(1,3,4-oxadiazol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one
SMILESO=c1cc[nH]c2nc(-c3nnco3)c(-c3ccc4ncccc4c3)cc12
InChIInChI=1S/C19H11N5O2/c25-16-5-7-21-18-14(16)9-13(17(23-18)19-24-22-10-26-19)11-3-4-15-12(8-11)2-1-6-20-15/h1-10H,(H,21,23,25)
InChIKeyINFPMRGYRGZABU-UHFFFAOYSA-N
MW341.33 g/mol
LogP3.19
Rot. Bonds2

About 7-(1,3,4-oxadiazol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one

7-(1,3,4-oxadiazol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one (PubChem CID 137437968) has the molecular formula C19H11N5O2 and a molecular weight of 341.33 g/mol. Its IUPAC name is 7-(1,3,4-oxadiazol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one.

Molecular Properties

Compound Name7-(1,3,4-oxadiazol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one
PubChem CID137437968
Molecular FormulaC19H11N5O2
Molecular Weight341.33 g/mol
Exact Mass341.09
IUPAC Name7-(1,3,4-oxadiazol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one
SMILESO=c1cc[nH]c2nc(-c3nnco3)c(-c3ccc4ncccc4c3)cc12
InChIInChI=1S/C19H11N5O2/c25-16-5-7-21-18-14(16)9-13(17(23-18)19-24-22-10-26-19)11-3-4-15-12(8-11)2-1-6-20-15/h1-10H,(H,21,23,25)
InChIKeyINFPMRGYRGZABU-UHFFFAOYSA-N
XLogP3.19
TPSA97.56 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.33
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one
CID 137423248
7-(5-methyl-1H-pyrrol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one
CID 137438504
7-(2-methyltriazol-4-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one
CID 137438402
2-methyl-3-(5-oxo-3-quinolin-6-yl-8H-1,8-naphthyridin-2-yl)benzonitrile
CID 154604994
2-fluoro-3-(5-oxo-3-quinolin-6-yl-8H-1,8-naphthyridin-2-yl)benzonitrile
CID 154604858
6-(1,8-naphthyridin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one
CID 137423219
4-oxo-7-[3-[6-(5-oxo-2-phenyl-8H-1,8-naphthyridin-3-yl)cinnolin-3-yl]phenyl]-6-quinolin-6-yl-1H-1,8-naphthyridine-3-carbonitrile
CID 155170926
6-(8-chloroquinolin-6-yl)-7-pyridin-3-yl-1H-1,8-naphthyridin-4-one
CID 137438341
6-(3H-benzimidazol-5-yl)-7-(furan-2-yl)-1H-1,8-naphthyridin-4-one
CID 137423273
6-(5-oxo-2-phenyl-8H-1,8-naphthyridin-3-yl)quinoline-2-carbonitrile
CID 137438727
7-(4-fluorophenyl)-6-pyridin-4-yl-1H-1,8-naphthyridin-4-one
CID 137438792
3-(2-methyl-1H-imidazol-5-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one
CID 154657357

Frequently Asked Questions

What is the IUPAC name of 7-(1,3,4-oxadiazol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one?
The IUPAC name of 7-(1,3,4-oxadiazol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one (CID 137437968) is 7-(1,3,4-oxadiazol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one.
What is the SMILES notation for 7-(1,3,4-oxadiazol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one?
The canonical SMILES for 7-(1,3,4-oxadiazol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one is O=c1cc[nH]c2nc(-c3nnco3)c(-c3ccc4ncccc4c3)cc12.
What is the InChIKey of 7-(1,3,4-oxadiazol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one?
The InChIKey is INFPMRGYRGZABU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11N5O2/c25-16-5-7-21-18-14(16)9-13(17(23-18)19-24-22-10-26-19)11-3-4-15-12(8-11)2-1-6-20-15/h1-10H,(H,21,23,25).
What are the key properties of 7-(1,3,4-oxadiazol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one?
7-(1,3,4-oxadiazol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one has a molecular weight of 341.33 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1,3,4-oxadiazol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one is sourced from PubChem (CID 137437968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).