2-phenyl-7-piperidin-1-yl-1H-1,8-naphthyridin-4-one

C19H19N3O — CID 11289724

IUPAC2-phenyl-7-piperidin-1-yl-1H-1,8-naphthyridin-4-one
SMILESO=c1cc(-c2ccccc2)[nH]c2nc(N3CCCCC3)ccc12
InChIInChI=1S/C19H19N3O/c23-17-13-16(14-7-3-1-4-8-14)20-19-15(17)9-10-18(21-19)22-11-5-2-6-12-22/h1,3-4,7-10,13H,2,5-6,11-12H2,(H,20,21,23)
InChIKeyOEGQXIGPVPYBKC-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.58
Rot. Bonds2

About 2-phenyl-7-piperidin-1-yl-1H-1,8-naphthyridin-4-one

2-phenyl-7-piperidin-1-yl-1H-1,8-naphthyridin-4-one (PubChem CID 11289724) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is 2-phenyl-7-piperidin-1-yl-1H-1,8-naphthyridin-4-one.

Molecular Properties

Compound Name2-phenyl-7-piperidin-1-yl-1H-1,8-naphthyridin-4-one
PubChem CID11289724
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name2-phenyl-7-piperidin-1-yl-1H-1,8-naphthyridin-4-one
SMILESO=c1cc(-c2ccccc2)[nH]c2nc(N3CCCCC3)ccc12
InChIInChI=1S/C19H19N3O/c23-17-13-16(14-7-3-1-4-8-14)20-19-15(17)9-10-18(21-19)22-11-5-2-6-12-22/h1,3-4,7-10,13H,2,5-6,11-12H2,(H,20,21,23)
InChIKeyOEGQXIGPVPYBKC-UHFFFAOYSA-N
XLogP3.58
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-7-piperidin-1-yl-1H-1,8-naphthyridin-4-one?
The IUPAC name of 2-phenyl-7-piperidin-1-yl-1H-1,8-naphthyridin-4-one (CID 11289724) is 2-phenyl-7-piperidin-1-yl-1H-1,8-naphthyridin-4-one.
What is the SMILES notation for 2-phenyl-7-piperidin-1-yl-1H-1,8-naphthyridin-4-one?
The canonical SMILES for 2-phenyl-7-piperidin-1-yl-1H-1,8-naphthyridin-4-one is O=c1cc(-c2ccccc2)[nH]c2nc(N3CCCCC3)ccc12.
What is the InChIKey of 2-phenyl-7-piperidin-1-yl-1H-1,8-naphthyridin-4-one?
The InChIKey is OEGQXIGPVPYBKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c23-17-13-16(14-7-3-1-4-8-14)20-19-15(17)9-10-18(21-19)22-11-5-2-6-12-22/h1,3-4,7-10,13H,2,5-6,11-12H2,(H,20,21,23).
What are the key properties of 2-phenyl-7-piperidin-1-yl-1H-1,8-naphthyridin-4-one?
2-phenyl-7-piperidin-1-yl-1H-1,8-naphthyridin-4-one has a molecular weight of 305.38 g/mol, XLogP of 3.58, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-7-piperidin-1-yl-1H-1,8-naphthyridin-4-one is sourced from PubChem (CID 11289724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).