1-phenyl-3,4-dihydroquinolin-2-one

C15H13NO — CID 5076748

IUPAC1-phenyl-3,4-dihydroquinolin-2-one
SMILESO=C1CCc2ccccc2N1c1ccccc1
InChIInChI=1S/C15H13NO/c17-15-11-10-12-6-4-5-9-14(12)16(15)13-7-2-1-3-8-13/h1-9H,10-11H2
InChIKeyKZVGADOBXOOISP-UHFFFAOYSA-N
MW223.28 g/mol
LogP3.30
Rot. Bonds1

About 1-phenyl-3,4-dihydroquinolin-2-one

1-phenyl-3,4-dihydroquinolin-2-one (PubChem CID 5076748) has the molecular formula C15H13NO and a molecular weight of 223.28 g/mol. Its IUPAC name is 1-phenyl-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name1-phenyl-3,4-dihydroquinolin-2-one
PubChem CID5076748
Molecular FormulaC15H13NO
Molecular Weight223.28 g/mol
Exact Mass223.10
IUPAC Name1-phenyl-3,4-dihydroquinolin-2-one
SMILESO=C1CCc2ccccc2N1c1ccccc1
InChIInChI=1S/C15H13NO/c17-15-11-10-12-6-4-5-9-14(12)16(15)13-7-2-1-3-8-13/h1-9H,10-11H2
InChIKeyKZVGADOBXOOISP-UHFFFAOYSA-N
XLogP3.30
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-3,4-dihydroquinolin-2-one?
The IUPAC name of 1-phenyl-3,4-dihydroquinolin-2-one (CID 5076748) is 1-phenyl-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 1-phenyl-3,4-dihydroquinolin-2-one?
The canonical SMILES for 1-phenyl-3,4-dihydroquinolin-2-one is O=C1CCc2ccccc2N1c1ccccc1.
What is the InChIKey of 1-phenyl-3,4-dihydroquinolin-2-one?
The InChIKey is KZVGADOBXOOISP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO/c17-15-11-10-12-6-4-5-9-14(12)16(15)13-7-2-1-3-8-13/h1-9H,10-11H2.
What are the key properties of 1-phenyl-3,4-dihydroquinolin-2-one?
1-phenyl-3,4-dihydroquinolin-2-one has a molecular weight of 223.28 g/mol, XLogP of 3.30, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 5076748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).