3-methyl-4-phenyl-1H-quinolin-2-one

C16H13NO — CID 616488

IUPAC3-methyl-4-phenyl-1H-quinolin-2-one
SMILESCc1c(-c2ccccc2)c2ccccc2[nH]c1=O
InChIInChI=1S/C16H13NO/c1-11-15(12-7-3-2-4-8-12)13-9-5-6-10-14(13)17-16(11)18/h2-10H,1H3,(H,17,18)
InChIKeyWRXGEZLZGNKKGJ-UHFFFAOYSA-N
MW235.29 g/mol
LogP3.50
Rot. Bonds1

About 3-methyl-4-phenyl-1H-quinolin-2-one

3-methyl-4-phenyl-1H-quinolin-2-one (PubChem CID 616488) has the molecular formula C16H13NO and a molecular weight of 235.29 g/mol. Its IUPAC name is 3-methyl-4-phenyl-1H-quinolin-2-one.

Molecular Properties

Compound Name3-methyl-4-phenyl-1H-quinolin-2-one
PubChem CID616488
Molecular FormulaC16H13NO
Molecular Weight235.29 g/mol
Exact Mass235.10
IUPAC Name3-methyl-4-phenyl-1H-quinolin-2-one
SMILESCc1c(-c2ccccc2)c2ccccc2[nH]c1=O
InChIInChI=1S/C16H13NO/c1-11-15(12-7-3-2-4-8-12)13-9-5-6-10-14(13)17-16(11)18/h2-10H,1H3,(H,17,18)
InChIKeyWRXGEZLZGNKKGJ-UHFFFAOYSA-N
XLogP3.50
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-phenyl-1H-quinolin-2-one?
The IUPAC name of 3-methyl-4-phenyl-1H-quinolin-2-one (CID 616488) is 3-methyl-4-phenyl-1H-quinolin-2-one.
What is the SMILES notation for 3-methyl-4-phenyl-1H-quinolin-2-one?
The canonical SMILES for 3-methyl-4-phenyl-1H-quinolin-2-one is Cc1c(-c2ccccc2)c2ccccc2[nH]c1=O.
What is the InChIKey of 3-methyl-4-phenyl-1H-quinolin-2-one?
The InChIKey is WRXGEZLZGNKKGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO/c1-11-15(12-7-3-2-4-8-12)13-9-5-6-10-14(13)17-16(11)18/h2-10H,1H3,(H,17,18).
What are the key properties of 3-methyl-4-phenyl-1H-quinolin-2-one?
3-methyl-4-phenyl-1H-quinolin-2-one has a molecular weight of 235.29 g/mol, XLogP of 3.50, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-phenyl-1H-quinolin-2-one is sourced from PubChem (CID 616488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).