4-phenyl-6-(2-phenyl-1,3-dioxolan-2-yl)-1H-quinolin-2-one

C24H19NO3 — CID 18715598

IUPAC4-phenyl-6-(2-phenyl-1,3-dioxolan-2-yl)-1H-quinolin-2-one
SMILESO=c1cc(-c2ccccc2)c2cc(C3(c4ccccc4)OCCO3)ccc2[nH]1
InChIInChI=1S/C24H19NO3/c26-23-16-20(17-7-3-1-4-8-17)21-15-19(11-12-22(21)25-23)24(27-13-14-28-24)18-9-5-2-6-10-18/h1-12,15-16H,13-14H2,(H,25,26)
InChIKeyPGHUSRNZWJMGFN-UHFFFAOYSA-N
MW369.42 g/mol
LogP4.44
Rot. Bonds3

About 4-phenyl-6-(2-phenyl-1,3-dioxolan-2-yl)-1H-quinolin-2-one

4-phenyl-6-(2-phenyl-1,3-dioxolan-2-yl)-1H-quinolin-2-one (PubChem CID 18715598) has the molecular formula C24H19NO3 and a molecular weight of 369.42 g/mol. Its IUPAC name is 4-phenyl-6-(2-phenyl-1,3-dioxolan-2-yl)-1H-quinolin-2-one.

Molecular Properties

Compound Name4-phenyl-6-(2-phenyl-1,3-dioxolan-2-yl)-1H-quinolin-2-one
PubChem CID18715598
Molecular FormulaC24H19NO3
Molecular Weight369.42 g/mol
Exact Mass369.14
IUPAC Name4-phenyl-6-(2-phenyl-1,3-dioxolan-2-yl)-1H-quinolin-2-one
SMILESO=c1cc(-c2ccccc2)c2cc(C3(c4ccccc4)OCCO3)ccc2[nH]1
InChIInChI=1S/C24H19NO3/c26-23-16-20(17-7-3-1-4-8-17)21-15-19(11-12-22(21)25-23)24(27-13-14-28-24)18-9-5-2-6-10-18/h1-12,15-16H,13-14H2,(H,25,26)
InChIKeyPGHUSRNZWJMGFN-UHFFFAOYSA-N
XLogP4.44
TPSA51.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-phenyl-6-(2-phenyl-1,3-dioxolan-2-yl)-1H-quinolin-2-one?
The IUPAC name of 4-phenyl-6-(2-phenyl-1,3-dioxolan-2-yl)-1H-quinolin-2-one (CID 18715598) is 4-phenyl-6-(2-phenyl-1,3-dioxolan-2-yl)-1H-quinolin-2-one.
What is the SMILES notation for 4-phenyl-6-(2-phenyl-1,3-dioxolan-2-yl)-1H-quinolin-2-one?
The canonical SMILES for 4-phenyl-6-(2-phenyl-1,3-dioxolan-2-yl)-1H-quinolin-2-one is O=c1cc(-c2ccccc2)c2cc(C3(c4ccccc4)OCCO3)ccc2[nH]1.
What is the InChIKey of 4-phenyl-6-(2-phenyl-1,3-dioxolan-2-yl)-1H-quinolin-2-one?
The InChIKey is PGHUSRNZWJMGFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19NO3/c26-23-16-20(17-7-3-1-4-8-17)21-15-19(11-12-22(21)25-23)24(27-13-14-28-24)18-9-5-2-6-10-18/h1-12,15-16H,13-14H2,(H,25,26).
What are the key properties of 4-phenyl-6-(2-phenyl-1,3-dioxolan-2-yl)-1H-quinolin-2-one?
4-phenyl-6-(2-phenyl-1,3-dioxolan-2-yl)-1H-quinolin-2-one has a molecular weight of 369.42 g/mol, XLogP of 4.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-6-(2-phenyl-1,3-dioxolan-2-yl)-1H-quinolin-2-one is sourced from PubChem (CID 18715598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).