4-phenyl-1-propyl-1,8-naphthyridin-2-one

C17H16N2O — CID 18969191

IUPAC4-phenyl-1-propyl-1,8-naphthyridin-2-one
SMILESCCCn1c(=O)cc(-c2ccccc2)c2cccnc21
InChIInChI=1S/C17H16N2O/c1-2-11-19-16(20)12-15(13-7-4-3-5-8-13)14-9-6-10-18-17(14)19/h3-10,12H,2,11H2,1H3
InChIKeyAXXNDJPZTTUTDO-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.47
Rot. Bonds3

About 4-phenyl-1-propyl-1,8-naphthyridin-2-one

4-phenyl-1-propyl-1,8-naphthyridin-2-one (PubChem CID 18969191) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 4-phenyl-1-propyl-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name4-phenyl-1-propyl-1,8-naphthyridin-2-one
PubChem CID18969191
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name4-phenyl-1-propyl-1,8-naphthyridin-2-one
SMILESCCCn1c(=O)cc(-c2ccccc2)c2cccnc21
InChIInChI=1S/C17H16N2O/c1-2-11-19-16(20)12-15(13-7-4-3-5-8-13)14-9-6-10-18-17(14)19/h3-10,12H,2,11H2,1H3
InChIKeyAXXNDJPZTTUTDO-UHFFFAOYSA-N
XLogP3.47
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-phenyl-1-propyl-1,8-naphthyridin-2-one?
The IUPAC name of 4-phenyl-1-propyl-1,8-naphthyridin-2-one (CID 18969191) is 4-phenyl-1-propyl-1,8-naphthyridin-2-one.
What is the SMILES notation for 4-phenyl-1-propyl-1,8-naphthyridin-2-one?
The canonical SMILES for 4-phenyl-1-propyl-1,8-naphthyridin-2-one is CCCn1c(=O)cc(-c2ccccc2)c2cccnc21.
What is the InChIKey of 4-phenyl-1-propyl-1,8-naphthyridin-2-one?
The InChIKey is AXXNDJPZTTUTDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-2-11-19-16(20)12-15(13-7-4-3-5-8-13)14-9-6-10-18-17(14)19/h3-10,12H,2,11H2,1H3.
What are the key properties of 4-phenyl-1-propyl-1,8-naphthyridin-2-one?
4-phenyl-1-propyl-1,8-naphthyridin-2-one has a molecular weight of 264.33 g/mol, XLogP of 3.47, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-1-propyl-1,8-naphthyridin-2-one is sourced from PubChem (CID 18969191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).