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

C17H11N3O — CID 137424823

IUPAC6-quinolin-6-yl-1H-1,8-naphthyridin-2-one
SMILESO=c1ccc2cc(-c3ccc4ncccc4c3)cnc2[nH]1
InChIInChI=1S/C17H11N3O/c21-16-6-4-13-9-14(10-19-17(13)20-16)11-3-5-15-12(8-11)2-1-7-18-15/h1-10H,(H,19,20,21)
InChIKeyFAQRCFGIXNZRIA-UHFFFAOYSA-N
MW273.30 g/mol
LogP3.14
Rot. Bonds1

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

6-quinolin-6-yl-1H-1,8-naphthyridin-2-one (PubChem CID 137424823) has the molecular formula C17H11N3O and a molecular weight of 273.30 g/mol. Its IUPAC name is 6-quinolin-6-yl-1H-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name6-quinolin-6-yl-1H-1,8-naphthyridin-2-one
PubChem CID137424823
Molecular FormulaC17H11N3O
Molecular Weight273.30 g/mol
Exact Mass273.09
IUPAC Name6-quinolin-6-yl-1H-1,8-naphthyridin-2-one
SMILESO=c1ccc2cc(-c3ccc4ncccc4c3)cnc2[nH]1
InChIInChI=1S/C17H11N3O/c21-16-6-4-13-9-14(10-19-17(13)20-16)11-3-5-15-12(8-11)2-1-7-18-15/h1-10H,(H,19,20,21)
InChIKeyFAQRCFGIXNZRIA-UHFFFAOYSA-N
XLogP3.14
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.30
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-quinolin-6-yl-1H-1,8-naphthyridin-2-one?
The IUPAC name of 6-quinolin-6-yl-1H-1,8-naphthyridin-2-one (CID 137424823) is 6-quinolin-6-yl-1H-1,8-naphthyridin-2-one.
What is the SMILES notation for 6-quinolin-6-yl-1H-1,8-naphthyridin-2-one?
The canonical SMILES for 6-quinolin-6-yl-1H-1,8-naphthyridin-2-one is O=c1ccc2cc(-c3ccc4ncccc4c3)cnc2[nH]1.
What is the InChIKey of 6-quinolin-6-yl-1H-1,8-naphthyridin-2-one?
The InChIKey is FAQRCFGIXNZRIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11N3O/c21-16-6-4-13-9-14(10-19-17(13)20-16)11-3-5-15-12(8-11)2-1-7-18-15/h1-10H,(H,19,20,21).
What are the key properties of 6-quinolin-6-yl-1H-1,8-naphthyridin-2-one?
6-quinolin-6-yl-1H-1,8-naphthyridin-2-one has a molecular weight of 273.30 g/mol, XLogP of 3.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-quinolin-6-yl-1H-1,8-naphthyridin-2-one is sourced from PubChem (CID 137424823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).