4-(naphthalen-1-ylamino)-2-phenyl-7,8-dihydro-6H-1,6-naphthyridin-5-one

C24H19N3O — CID 53493860

IUPAC4-(naphthalen-1-ylamino)-2-phenyl-7,8-dihydro-6H-1,6-naphthyridin-5-one
SMILESO=C1NCCc2nc(-c3ccccc3)cc(Nc3cccc4ccccc34)c21
InChIInChI=1S/C24H19N3O/c28-24-23-20(13-14-25-24)27-21(17-8-2-1-3-9-17)15-22(23)26-19-12-6-10-16-7-4-5-11-18(16)19/h1-12,15H,13-14H2,(H,25,28)(H,26,27)
InChIKeyQLPSDYKTPWYQJI-UHFFFAOYSA-N
MW365.44 g/mol
LogP4.93
Rot. Bonds3

About 4-(naphthalen-1-ylamino)-2-phenyl-7,8-dihydro-6H-1,6-naphthyridin-5-one

4-(naphthalen-1-ylamino)-2-phenyl-7,8-dihydro-6H-1,6-naphthyridin-5-one (PubChem CID 53493860) has the molecular formula C24H19N3O and a molecular weight of 365.44 g/mol. Its IUPAC name is 4-(naphthalen-1-ylamino)-2-phenyl-7,8-dihydro-6H-1,6-naphthyridin-5-one.

Molecular Properties

Compound Name4-(naphthalen-1-ylamino)-2-phenyl-7,8-dihydro-6H-1,6-naphthyridin-5-one
PubChem CID53493860
Molecular FormulaC24H19N3O
Molecular Weight365.44 g/mol
Exact Mass365.15
IUPAC Name4-(naphthalen-1-ylamino)-2-phenyl-7,8-dihydro-6H-1,6-naphthyridin-5-one
SMILESO=C1NCCc2nc(-c3ccccc3)cc(Nc3cccc4ccccc34)c21
InChIInChI=1S/C24H19N3O/c28-24-23-20(13-14-25-24)27-21(17-8-2-1-3-9-17)15-22(23)26-19-12-6-10-16-7-4-5-11-18(16)19/h1-12,15H,13-14H2,(H,25,28)(H,26,27)
InChIKeyQLPSDYKTPWYQJI-UHFFFAOYSA-N
XLogP4.93
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.44
LogP ≤ 54.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(naphthalen-1-ylamino)-2-phenyl-7,8-dihydro-6H-1,6-naphthyridin-5-one?
The IUPAC name of 4-(naphthalen-1-ylamino)-2-phenyl-7,8-dihydro-6H-1,6-naphthyridin-5-one (CID 53493860) is 4-(naphthalen-1-ylamino)-2-phenyl-7,8-dihydro-6H-1,6-naphthyridin-5-one.
What is the SMILES notation for 4-(naphthalen-1-ylamino)-2-phenyl-7,8-dihydro-6H-1,6-naphthyridin-5-one?
The canonical SMILES for 4-(naphthalen-1-ylamino)-2-phenyl-7,8-dihydro-6H-1,6-naphthyridin-5-one is O=C1NCCc2nc(-c3ccccc3)cc(Nc3cccc4ccccc34)c21.
What is the InChIKey of 4-(naphthalen-1-ylamino)-2-phenyl-7,8-dihydro-6H-1,6-naphthyridin-5-one?
The InChIKey is QLPSDYKTPWYQJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N3O/c28-24-23-20(13-14-25-24)27-21(17-8-2-1-3-9-17)15-22(23)26-19-12-6-10-16-7-4-5-11-18(16)19/h1-12,15H,13-14H2,(H,25,28)(H,26,27).
What are the key properties of 4-(naphthalen-1-ylamino)-2-phenyl-7,8-dihydro-6H-1,6-naphthyridin-5-one?
4-(naphthalen-1-ylamino)-2-phenyl-7,8-dihydro-6H-1,6-naphthyridin-5-one has a molecular weight of 365.44 g/mol, XLogP of 4.93, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(naphthalen-1-ylamino)-2-phenyl-7,8-dihydro-6H-1,6-naphthyridin-5-one is sourced from PubChem (CID 53493860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).