4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one

C18H15NO — CID 142303338

IUPAC4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one
SMILESC=C(C)c1c(-c2ccccc2)c2ccccc2[nH]c1=O
InChIInChI=1S/C18H15NO/c1-12(2)16-17(13-8-4-3-5-9-13)14-10-6-7-11-15(14)19-18(16)20/h3-11H,1H2,2H3,(H,19,20)
InChIKeyXTZSDQCIHVSXSF-UHFFFAOYSA-N
MW261.32 g/mol
LogP4.23
Rot. Bonds2

About 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one

4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one (PubChem CID 142303338) has the molecular formula C18H15NO and a molecular weight of 261.32 g/mol. Its IUPAC name is 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one.

Molecular Properties

Compound Name4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one
PubChem CID142303338
Molecular FormulaC18H15NO
Molecular Weight261.32 g/mol
Exact Mass261.12
IUPAC Name4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one
SMILESC=C(C)c1c(-c2ccccc2)c2ccccc2[nH]c1=O
InChIInChI=1S/C18H15NO/c1-12(2)16-17(13-8-4-3-5-9-13)14-10-6-7-11-15(14)19-18(16)20/h3-11H,1H2,2H3,(H,19,20)
InChIKeyXTZSDQCIHVSXSF-UHFFFAOYSA-N
XLogP4.23
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one?
The IUPAC name of 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one (CID 142303338) is 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one.
What is the SMILES notation for 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one?
The canonical SMILES for 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one is C=C(C)c1c(-c2ccccc2)c2ccccc2[nH]c1=O.
What is the InChIKey of 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one?
The InChIKey is XTZSDQCIHVSXSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO/c1-12(2)16-17(13-8-4-3-5-9-13)14-10-6-7-11-15(14)19-18(16)20/h3-11H,1H2,2H3,(H,19,20).
What are the key properties of 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one?
4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one has a molecular weight of 261.32 g/mol, XLogP of 4.23, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-3-prop-1-en-2-yl-1H-quinolin-2-one is sourced from PubChem (CID 142303338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).