3-methyl-6,7-dihydro-1H-quinolin-2-one

C10H11NO — CID 144546014

IUPAC3-methyl-6,7-dihydro-1H-quinolin-2-one
SMILESCc1cc2c([nH]c1=O)=CCCC=2
InChIInChI=1S/C10H11NO/c1-7-6-8-4-2-3-5-9(8)11-10(7)12/h4-6H,2-3H2,1H3,(H,11,12)
InChIKeyORGSUKUSBBEUBF-UHFFFAOYSA-N
MW161.20 g/mol
LogP0.04
Rot. Bonds

About 3-methyl-6,7-dihydro-1H-quinolin-2-one

3-methyl-6,7-dihydro-1H-quinolin-2-one (PubChem CID 144546014) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is 3-methyl-6,7-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name3-methyl-6,7-dihydro-1H-quinolin-2-one
PubChem CID144546014
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name3-methyl-6,7-dihydro-1H-quinolin-2-one
SMILESCc1cc2c([nH]c1=O)=CCCC=2
InChIInChI=1S/C10H11NO/c1-7-6-8-4-2-3-5-9(8)11-10(7)12/h4-6H,2-3H2,1H3,(H,11,12)
InChIKeyORGSUKUSBBEUBF-UHFFFAOYSA-N
XLogP0.04
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-6,7-dihydro-1H-quinolin-2-one?
The IUPAC name of 3-methyl-6,7-dihydro-1H-quinolin-2-one (CID 144546014) is 3-methyl-6,7-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 3-methyl-6,7-dihydro-1H-quinolin-2-one?
The canonical SMILES for 3-methyl-6,7-dihydro-1H-quinolin-2-one is Cc1cc2c([nH]c1=O)=CCCC=2.
What is the InChIKey of 3-methyl-6,7-dihydro-1H-quinolin-2-one?
The InChIKey is ORGSUKUSBBEUBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO/c1-7-6-8-4-2-3-5-9(8)11-10(7)12/h4-6H,2-3H2,1H3,(H,11,12).
What are the key properties of 3-methyl-6,7-dihydro-1H-quinolin-2-one?
3-methyl-6,7-dihydro-1H-quinolin-2-one has a molecular weight of 161.20 g/mol, XLogP of 0.04, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6,7-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 144546014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).