2-methyl-2H-quinolin-3-one

C10H9NO — CID 73011166

IUPAC2-methyl-2H-quinolin-3-one
SMILESCC1N=c2ccccc2=CC1=O
InChIInChI=1S/C10H9NO/c1-7-10(12)6-8-4-2-3-5-9(8)11-7/h2-7H,1H3
InChIKeyLRUINIXCQQPWJZ-UHFFFAOYSA-N
MW159.19 g/mol
LogP0.06
Rot. Bonds

About 2-methyl-2H-quinolin-3-one

2-methyl-2H-quinolin-3-one (PubChem CID 73011166) has the molecular formula C10H9NO and a molecular weight of 159.19 g/mol. Its IUPAC name is 2-methyl-2H-quinolin-3-one.

Molecular Properties

Compound Name2-methyl-2H-quinolin-3-one
PubChem CID73011166
Molecular FormulaC10H9NO
Molecular Weight159.19 g/mol
Exact Mass159.07
IUPAC Name2-methyl-2H-quinolin-3-one
SMILESCC1N=c2ccccc2=CC1=O
InChIInChI=1S/C10H9NO/c1-7-10(12)6-8-4-2-3-5-9(8)11-7/h2-7H,1H3
InChIKeyLRUINIXCQQPWJZ-UHFFFAOYSA-N
XLogP0.06
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 50.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2H-quinolin-3-one?
The IUPAC name of 2-methyl-2H-quinolin-3-one (CID 73011166) is 2-methyl-2H-quinolin-3-one.
What is the SMILES notation for 2-methyl-2H-quinolin-3-one?
The canonical SMILES for 2-methyl-2H-quinolin-3-one is CC1N=c2ccccc2=CC1=O.
What is the InChIKey of 2-methyl-2H-quinolin-3-one?
The InChIKey is LRUINIXCQQPWJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO/c1-7-10(12)6-8-4-2-3-5-9(8)11-7/h2-7H,1H3.
What are the key properties of 2-methyl-2H-quinolin-3-one?
2-methyl-2H-quinolin-3-one has a molecular weight of 159.19 g/mol, XLogP of 0.06, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2H-quinolin-3-one is sourced from PubChem (CID 73011166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).