6-methyl-3,4-dihydroquinolizin-2-one

C10H11NO — CID 70598331

IUPAC6-methyl-3,4-dihydroquinolizin-2-one
SMILESCC1=CC=CC2=CC(=O)CCN12
InChIInChI=1S/C10H11NO/c1-8-3-2-4-9-7-10(12)5-6-11(8)9/h2-4,7H,5-6H2,1H3
InChIKeyCBCIETJYEGQTBW-UHFFFAOYSA-N
MW161.20 g/mol
LogP1.62
Rot. Bonds

About 6-methyl-3,4-dihydroquinolizin-2-one

6-methyl-3,4-dihydroquinolizin-2-one (PubChem CID 70598331) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is 6-methyl-3,4-dihydroquinolizin-2-one.

Molecular Properties

Compound Name6-methyl-3,4-dihydroquinolizin-2-one
PubChem CID70598331
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name6-methyl-3,4-dihydroquinolizin-2-one
SMILESCC1=CC=CC2=CC(=O)CCN12
InChIInChI=1S/C10H11NO/c1-8-3-2-4-9-7-10(12)5-6-11(8)9/h2-4,7H,5-6H2,1H3
InChIKeyCBCIETJYEGQTBW-UHFFFAOYSA-N
XLogP1.62
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3,4-dihydroquinolizin-2-one?
The IUPAC name of 6-methyl-3,4-dihydroquinolizin-2-one (CID 70598331) is 6-methyl-3,4-dihydroquinolizin-2-one.
What is the SMILES notation for 6-methyl-3,4-dihydroquinolizin-2-one?
The canonical SMILES for 6-methyl-3,4-dihydroquinolizin-2-one is CC1=CC=CC2=CC(=O)CCN12.
What is the InChIKey of 6-methyl-3,4-dihydroquinolizin-2-one?
The InChIKey is CBCIETJYEGQTBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO/c1-8-3-2-4-9-7-10(12)5-6-11(8)9/h2-4,7H,5-6H2,1H3.
What are the key properties of 6-methyl-3,4-dihydroquinolizin-2-one?
6-methyl-3,4-dihydroquinolizin-2-one has a molecular weight of 161.20 g/mol, XLogP of 1.62, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3,4-dihydroquinolizin-2-one is sourced from PubChem (CID 70598331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).