3-chloro-2-(2-fluorophenyl)-6H-1,6-naphthyridin-5-one

C14H8ClFN2O — CID 146235111

IUPAC3-chloro-2-(2-fluorophenyl)-6H-1,6-naphthyridin-5-one
SMILESO=c1[nH]ccc2nc(-c3ccccc3F)c(Cl)cc12
InChIInChI=1S/C14H8ClFN2O/c15-10-7-9-12(5-6-17-14(9)19)18-13(10)8-3-1-2-4-11(8)16/h1-7H,(H,17,19)
InChIKeyCZHJGFCQOGHQBR-UHFFFAOYSA-N
MW274.68 g/mol
LogP3.38
Rot. Bonds1

About 3-chloro-2-(2-fluorophenyl)-6H-1,6-naphthyridin-5-one

3-chloro-2-(2-fluorophenyl)-6H-1,6-naphthyridin-5-one (PubChem CID 146235111) has the molecular formula C14H8ClFN2O and a molecular weight of 274.68 g/mol. Its IUPAC name is 3-chloro-2-(2-fluorophenyl)-6H-1,6-naphthyridin-5-one.

Molecular Properties

Compound Name3-chloro-2-(2-fluorophenyl)-6H-1,6-naphthyridin-5-one
PubChem CID146235111
Molecular FormulaC14H8ClFN2O
Molecular Weight274.68 g/mol
Exact Mass274.03
IUPAC Name3-chloro-2-(2-fluorophenyl)-6H-1,6-naphthyridin-5-one
SMILESO=c1[nH]ccc2nc(-c3ccccc3F)c(Cl)cc12
InChIInChI=1S/C14H8ClFN2O/c15-10-7-9-12(5-6-17-14(9)19)18-13(10)8-3-1-2-4-11(8)16/h1-7H,(H,17,19)
InChIKeyCZHJGFCQOGHQBR-UHFFFAOYSA-N
XLogP3.38
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.68
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-(2-fluorophenyl)-6H-1,6-naphthyridin-5-one?
The IUPAC name of 3-chloro-2-(2-fluorophenyl)-6H-1,6-naphthyridin-5-one (CID 146235111) is 3-chloro-2-(2-fluorophenyl)-6H-1,6-naphthyridin-5-one.
What is the SMILES notation for 3-chloro-2-(2-fluorophenyl)-6H-1,6-naphthyridin-5-one?
The canonical SMILES for 3-chloro-2-(2-fluorophenyl)-6H-1,6-naphthyridin-5-one is O=c1[nH]ccc2nc(-c3ccccc3F)c(Cl)cc12.
What is the InChIKey of 3-chloro-2-(2-fluorophenyl)-6H-1,6-naphthyridin-5-one?
The InChIKey is CZHJGFCQOGHQBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8ClFN2O/c15-10-7-9-12(5-6-17-14(9)19)18-13(10)8-3-1-2-4-11(8)16/h1-7H,(H,17,19).
What are the key properties of 3-chloro-2-(2-fluorophenyl)-6H-1,6-naphthyridin-5-one?
3-chloro-2-(2-fluorophenyl)-6H-1,6-naphthyridin-5-one has a molecular weight of 274.68 g/mol, XLogP of 3.38, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-(2-fluorophenyl)-6H-1,6-naphthyridin-5-one is sourced from PubChem (CID 146235111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).