2-phenyl-3-pyridin-4-ylisoquinolin-1-one

C20H14N2O — CID 15193134

IUPAC2-phenyl-3-pyridin-4-ylisoquinolin-1-one
SMILESO=c1c2ccccc2cc(-c2ccncc2)n1-c1ccccc1
InChIInChI=1S/C20H14N2O/c23-20-18-9-5-4-6-16(18)14-19(15-10-12-21-13-11-15)22(20)17-7-2-1-3-8-17/h1-14H
InChIKeySUZISXHBCMOYAS-UHFFFAOYSA-N
MW298.35 g/mol
LogP4.05
Rot. Bonds2

About 2-phenyl-3-pyridin-4-ylisoquinolin-1-one

2-phenyl-3-pyridin-4-ylisoquinolin-1-one (PubChem CID 15193134) has the molecular formula C20H14N2O and a molecular weight of 298.35 g/mol. Its IUPAC name is 2-phenyl-3-pyridin-4-ylisoquinolin-1-one.

Molecular Properties

Compound Name2-phenyl-3-pyridin-4-ylisoquinolin-1-one
PubChem CID15193134
Molecular FormulaC20H14N2O
Molecular Weight298.35 g/mol
Exact Mass298.11
IUPAC Name2-phenyl-3-pyridin-4-ylisoquinolin-1-one
SMILESO=c1c2ccccc2cc(-c2ccncc2)n1-c1ccccc1
InChIInChI=1S/C20H14N2O/c23-20-18-9-5-4-6-16(18)14-19(15-10-12-21-13-11-15)22(20)17-7-2-1-3-8-17/h1-14H
InChIKeySUZISXHBCMOYAS-UHFFFAOYSA-N
XLogP4.05
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-methylsulfanylphenyl)-2-phenylisoquinolin-1-one
CID 102338686
2-phenyl-3-(3,4,5-trimethoxyphenyl)isoquinolin-1-one
CID 102338690
1-(3,5-diphenylphenyl)-8-phenyl-2,7-dipyridin-4-ylpyrrolo[3,2-g]indole
CID 163770225
2-(4-phenylphenyl)-3-pyridin-4-ylquinazolin-4-one
CID 1047183
2-(1,3-diphenylpyrazol-5-yl)-3-phenylquinazolin-4-one
CID 102437700
6-phenylisoquinolino[2,1-b]isoquinolin-8-one
CID 164679594
3-pyridin-4-ylnaphthalene-1-carboxylic acid
CID 3348527
2-[3-(4-oxo-3-phenylquinazolin-2-yl)-5-phenylphenyl]-3-phenylquinazolin-4-one
CID 121247434
9-phenyl-3,6-bis(2-phenyl-6-pyridin-4-ylpyrimidin-4-yl)carbazole
CID 167146293
1,2,6-triphenylpyridin-4-one
CID 13088641
7,17-diphenyl-7,17-diazapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1(20),2,4,9,11,13,15(19)-heptaene-6,8,16,18-tetrone
CID 10073329
4-hydroxy-1,3-diphenyl-6-pyridin-3-ylpyridin-2-one
CID 54690659

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-3-pyridin-4-ylisoquinolin-1-one?
The IUPAC name of 2-phenyl-3-pyridin-4-ylisoquinolin-1-one (CID 15193134) is 2-phenyl-3-pyridin-4-ylisoquinolin-1-one.
What is the SMILES notation for 2-phenyl-3-pyridin-4-ylisoquinolin-1-one?
The canonical SMILES for 2-phenyl-3-pyridin-4-ylisoquinolin-1-one is O=c1c2ccccc2cc(-c2ccncc2)n1-c1ccccc1.
What is the InChIKey of 2-phenyl-3-pyridin-4-ylisoquinolin-1-one?
The InChIKey is SUZISXHBCMOYAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N2O/c23-20-18-9-5-4-6-16(18)14-19(15-10-12-21-13-11-15)22(20)17-7-2-1-3-8-17/h1-14H.
What are the key properties of 2-phenyl-3-pyridin-4-ylisoquinolin-1-one?
2-phenyl-3-pyridin-4-ylisoquinolin-1-one has a molecular weight of 298.35 g/mol, XLogP of 4.05, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-3-pyridin-4-ylisoquinolin-1-one is sourced from PubChem (CID 15193134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).