7-methylidene-8,9-dihydro-6H-quinolizin-4-one

C10H11NO — CID 134971128

IUPAC7-methylidene-8,9-dihydro-6H-quinolizin-4-one
SMILESC=C1CCc2cccc(=O)n2C1
InChIInChI=1S/C10H11NO/c1-8-5-6-9-3-2-4-10(12)11(9)7-8/h2-4H,1,5-7H2
InChIKeyQWHLFAHKZMDVSM-UHFFFAOYSA-N
MW161.20 g/mol
LogP1.35
Rot. Bonds

About 7-methylidene-8,9-dihydro-6H-quinolizin-4-one

7-methylidene-8,9-dihydro-6H-quinolizin-4-one (PubChem CID 134971128) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is 7-methylidene-8,9-dihydro-6H-quinolizin-4-one.

Molecular Properties

Compound Name7-methylidene-8,9-dihydro-6H-quinolizin-4-one
PubChem CID134971128
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name7-methylidene-8,9-dihydro-6H-quinolizin-4-one
SMILESC=C1CCc2cccc(=O)n2C1
InChIInChI=1S/C10H11NO/c1-8-5-6-9-3-2-4-10(12)11(9)7-8/h2-4H,1,5-7H2
InChIKeyQWHLFAHKZMDVSM-UHFFFAOYSA-N
XLogP1.35
TPSA22.00 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 ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(2E,4E)-5,9-dimethyl-1-piperidin-1-yldeca-2,4,8-trien-1-one
CID 44561415
6,7,8,9-Tetrahydroquinolizin-4-one
CID 13616826
7-amino-2,3,4,6-tetrahydro-1H-quinolizin-6-one hydrochloride
CID 155821872
1-Butyl-5,6,7,8-tetrahydro-1h-quinolin-2-one
CID 13169241
1-Butyl-3-methyl-5,6,7,8-tetrahydro-1h-quinolin-2-one
CID 13169243
(6R,7S)-6,7-dimethyl-6,7,8,9-tetrahydroquinolizin-4-one
CID 58622703
9-Methyl-6,7,8,9-tetrahydroquinolizin-4-one
CID 102163877
Tetrahydrobenzo[a]quinolizine-4-one
CID 118609799
(9S)-9-methyl-6,7,8,9-tetrahydroquinolizin-4-one
CID 125482296
6-Methyl-6,7,8,9-tetrahydroquinolizin-4-one
CID 132967691
3-Methyl-2-(trifluoromethyl)-6,7,8,9-tetrahydroquinolizin-4-one
CID 59284218
6-[(3Z)-5-fluorohexa-1,3,5-trien-2-yl]-1,6,7,8,9,9a-hexahydroquinolizin-4-one
CID 143857744

Frequently Asked Questions

What is the IUPAC name of 7-methylidene-8,9-dihydro-6H-quinolizin-4-one?
The IUPAC name of 7-methylidene-8,9-dihydro-6H-quinolizin-4-one (CID 134971128) is 7-methylidene-8,9-dihydro-6H-quinolizin-4-one.
What is the SMILES notation for 7-methylidene-8,9-dihydro-6H-quinolizin-4-one?
The canonical SMILES for 7-methylidene-8,9-dihydro-6H-quinolizin-4-one is C=C1CCc2cccc(=O)n2C1.
What is the InChIKey of 7-methylidene-8,9-dihydro-6H-quinolizin-4-one?
The InChIKey is QWHLFAHKZMDVSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO/c1-8-5-6-9-3-2-4-10(12)11(9)7-8/h2-4H,1,5-7H2.
What are the key properties of 7-methylidene-8,9-dihydro-6H-quinolizin-4-one?
7-methylidene-8,9-dihydro-6H-quinolizin-4-one has a molecular weight of 161.20 g/mol, XLogP of 1.35, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methylidene-8,9-dihydro-6H-quinolizin-4-one is sourced from PubChem (CID 134971128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).