7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one

C23H15N3O — CID 137423260

IUPAC7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one
SMILESO=c1ccc2cc(-c3ccc4ncccc4c3)c(-c3ccccc3)nc2[nH]1
InChIInChI=1S/C23H15N3O/c27-21-11-9-18-14-19(16-8-10-20-17(13-16)7-4-12-24-20)22(26-23(18)25-21)15-5-2-1-3-6-15/h1-14H,(H,25,26,27)
InChIKeyAOXQMTUDHOFRAJ-UHFFFAOYSA-N
MW349.39 g/mol
LogP4.81
Rot. Bonds2

About 7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one

7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one (PubChem CID 137423260) has the molecular formula C23H15N3O and a molecular weight of 349.39 g/mol. Its IUPAC name is 7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one
PubChem CID137423260
Molecular FormulaC23H15N3O
Molecular Weight349.39 g/mol
Exact Mass349.12
IUPAC Name7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one
SMILESO=c1ccc2cc(-c3ccc4ncccc4c3)c(-c3ccccc3)nc2[nH]1
InChIInChI=1S/C23H15N3O/c27-21-11-9-18-14-19(16-8-10-20-17(13-16)7-4-12-24-20)22(26-23(18)25-21)15-5-2-1-3-6-15/h1-14H,(H,25,26,27)
InChIKeyAOXQMTUDHOFRAJ-UHFFFAOYSA-N
XLogP4.81
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one?
The IUPAC name of 7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one (CID 137423260) is 7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one.
What is the SMILES notation for 7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one?
The canonical SMILES for 7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one is O=c1ccc2cc(-c3ccc4ncccc4c3)c(-c3ccccc3)nc2[nH]1.
What is the InChIKey of 7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one?
The InChIKey is AOXQMTUDHOFRAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15N3O/c27-21-11-9-18-14-19(16-8-10-20-17(13-16)7-4-12-24-20)22(26-23(18)25-21)15-5-2-1-3-6-15/h1-14H,(H,25,26,27).
What are the key properties of 7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one?
7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one has a molecular weight of 349.39 g/mol, XLogP of 4.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one is sourced from PubChem (CID 137423260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).