3-ethyl-4-hydroxy-1-phenyl-1,8-naphthyridin-2-one

C16H14N2O2 — CID 54729693

IUPAC3-ethyl-4-hydroxy-1-phenyl-1,8-naphthyridin-2-one
SMILESCCc1c(O)c2cccnc2n(-c2ccccc2)c1=O
InChIInChI=1S/C16H14N2O2/c1-2-12-14(19)13-9-6-10-17-15(13)18(16(12)20)11-7-4-3-5-8-11/h3-10,19H,2H2,1H3
InChIKeyWAWZIVKGTVHQQG-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.65
Rot. Bonds2

About 3-ethyl-4-hydroxy-1-phenyl-1,8-naphthyridin-2-one

3-ethyl-4-hydroxy-1-phenyl-1,8-naphthyridin-2-one (PubChem CID 54729693) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 3-ethyl-4-hydroxy-1-phenyl-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name3-ethyl-4-hydroxy-1-phenyl-1,8-naphthyridin-2-one
PubChem CID54729693
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name3-ethyl-4-hydroxy-1-phenyl-1,8-naphthyridin-2-one
SMILESCCc1c(O)c2cccnc2n(-c2ccccc2)c1=O
InChIInChI=1S/C16H14N2O2/c1-2-12-14(19)13-9-6-10-17-15(13)18(16(12)20)11-7-4-3-5-8-11/h3-10,19H,2H2,1H3
InChIKeyWAWZIVKGTVHQQG-UHFFFAOYSA-N
XLogP2.65
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4-hydroxy-1-phenyl-1,8-naphthyridin-2-one?
The IUPAC name of 3-ethyl-4-hydroxy-1-phenyl-1,8-naphthyridin-2-one (CID 54729693) is 3-ethyl-4-hydroxy-1-phenyl-1,8-naphthyridin-2-one.
What is the SMILES notation for 3-ethyl-4-hydroxy-1-phenyl-1,8-naphthyridin-2-one?
The canonical SMILES for 3-ethyl-4-hydroxy-1-phenyl-1,8-naphthyridin-2-one is CCc1c(O)c2cccnc2n(-c2ccccc2)c1=O.
What is the InChIKey of 3-ethyl-4-hydroxy-1-phenyl-1,8-naphthyridin-2-one?
The InChIKey is WAWZIVKGTVHQQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c1-2-12-14(19)13-9-6-10-17-15(13)18(16(12)20)11-7-4-3-5-8-11/h3-10,19H,2H2,1H3.
What are the key properties of 3-ethyl-4-hydroxy-1-phenyl-1,8-naphthyridin-2-one?
3-ethyl-4-hydroxy-1-phenyl-1,8-naphthyridin-2-one has a molecular weight of 266.30 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4-hydroxy-1-phenyl-1,8-naphthyridin-2-one is sourced from PubChem (CID 54729693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).