4-methyl-7-phenyl-1H-quinolin-2-one

C16H13NO — CID 73347342

IUPAC4-methyl-7-phenyl-1H-quinolin-2-one
SMILESCc1cc(=O)[nH]c2cc(-c3ccccc3)ccc12
InChIInChI=1S/C16H13NO/c1-11-9-16(18)17-15-10-13(7-8-14(11)15)12-5-3-2-4-6-12/h2-10H,1H3,(H,17,18)
InChIKeyBTNDHWMSGWYSIL-UHFFFAOYSA-N
MW235.29 g/mol
LogP3.50
Rot. Bonds1

About 4-methyl-7-phenyl-1H-quinolin-2-one

4-methyl-7-phenyl-1H-quinolin-2-one (PubChem CID 73347342) has the molecular formula C16H13NO and a molecular weight of 235.29 g/mol. Its IUPAC name is 4-methyl-7-phenyl-1H-quinolin-2-one.

Molecular Properties

Compound Name4-methyl-7-phenyl-1H-quinolin-2-one
PubChem CID73347342
Molecular FormulaC16H13NO
Molecular Weight235.29 g/mol
Exact Mass235.10
IUPAC Name4-methyl-7-phenyl-1H-quinolin-2-one
SMILESCc1cc(=O)[nH]c2cc(-c3ccccc3)ccc12
InChIInChI=1S/C16H13NO/c1-11-9-16(18)17-15-10-13(7-8-14(11)15)12-5-3-2-4-6-12/h2-10H,1H3,(H,17,18)
InChIKeyBTNDHWMSGWYSIL-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 4-methyl-7-phenyl-1H-quinolin-2-one?
The IUPAC name of 4-methyl-7-phenyl-1H-quinolin-2-one (CID 73347342) is 4-methyl-7-phenyl-1H-quinolin-2-one.
What is the SMILES notation for 4-methyl-7-phenyl-1H-quinolin-2-one?
The canonical SMILES for 4-methyl-7-phenyl-1H-quinolin-2-one is Cc1cc(=O)[nH]c2cc(-c3ccccc3)ccc12.
What is the InChIKey of 4-methyl-7-phenyl-1H-quinolin-2-one?
The InChIKey is BTNDHWMSGWYSIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO/c1-11-9-16(18)17-15-10-13(7-8-14(11)15)12-5-3-2-4-6-12/h2-10H,1H3,(H,17,18).
What are the key properties of 4-methyl-7-phenyl-1H-quinolin-2-one?
4-methyl-7-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 4-methyl-7-phenyl-1H-quinolin-2-one is sourced from PubChem (CID 73347342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).