7-chloro-4-hydroxy-3-phenyl-1H-1,5-naphthyridin-2-one

C14H9ClN2O2 — CID 54730156

IUPAC7-chloro-4-hydroxy-3-phenyl-1H-1,5-naphthyridin-2-one
SMILESO=c1[nH]c2cc(Cl)cnc2c(O)c1-c1ccccc1
InChIInChI=1S/C14H9ClN2O2/c15-9-6-10-12(16-7-9)13(18)11(14(19)17-10)8-4-2-1-3-5-8/h1-7H,(H2,17,18,19)
InChIKeyPCPUHSXRCOXBKI-UHFFFAOYSA-N
MW272.69 g/mol
LogP2.95
Rot. Bonds1

About 7-chloro-4-hydroxy-3-phenyl-1H-1,5-naphthyridin-2-one

7-chloro-4-hydroxy-3-phenyl-1H-1,5-naphthyridin-2-one (PubChem CID 54730156) has the molecular formula C14H9ClN2O2 and a molecular weight of 272.69 g/mol. Its IUPAC name is 7-chloro-4-hydroxy-3-phenyl-1H-1,5-naphthyridin-2-one.

Molecular Properties

Compound Name7-chloro-4-hydroxy-3-phenyl-1H-1,5-naphthyridin-2-one
PubChem CID54730156
Molecular FormulaC14H9ClN2O2
Molecular Weight272.69 g/mol
Exact Mass272.04
IUPAC Name7-chloro-4-hydroxy-3-phenyl-1H-1,5-naphthyridin-2-one
SMILESO=c1[nH]c2cc(Cl)cnc2c(O)c1-c1ccccc1
InChIInChI=1S/C14H9ClN2O2/c15-9-6-10-12(16-7-9)13(18)11(14(19)17-10)8-4-2-1-3-5-8/h1-7H,(H2,17,18,19)
InChIKeyPCPUHSXRCOXBKI-UHFFFAOYSA-N
XLogP2.95
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.69
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-4-hydroxy-3-phenyl-1H-1,5-naphthyridin-2-one?
The IUPAC name of 7-chloro-4-hydroxy-3-phenyl-1H-1,5-naphthyridin-2-one (CID 54730156) is 7-chloro-4-hydroxy-3-phenyl-1H-1,5-naphthyridin-2-one.
What is the SMILES notation for 7-chloro-4-hydroxy-3-phenyl-1H-1,5-naphthyridin-2-one?
The canonical SMILES for 7-chloro-4-hydroxy-3-phenyl-1H-1,5-naphthyridin-2-one is O=c1[nH]c2cc(Cl)cnc2c(O)c1-c1ccccc1.
What is the InChIKey of 7-chloro-4-hydroxy-3-phenyl-1H-1,5-naphthyridin-2-one?
The InChIKey is PCPUHSXRCOXBKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClN2O2/c15-9-6-10-12(16-7-9)13(18)11(14(19)17-10)8-4-2-1-3-5-8/h1-7H,(H2,17,18,19).
What are the key properties of 7-chloro-4-hydroxy-3-phenyl-1H-1,5-naphthyridin-2-one?
7-chloro-4-hydroxy-3-phenyl-1H-1,5-naphthyridin-2-one has a molecular weight of 272.69 g/mol, XLogP of 2.95, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-4-hydroxy-3-phenyl-1H-1,5-naphthyridin-2-one is sourced from PubChem (CID 54730156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).