(8aS)-6,7,8,8a-tetrahydro-5H-indolizin-3-one

C8H11NO — CID 10953577

IUPAC(8aS)-6,7,8,8a-tetrahydro-5H-indolizin-3-one
SMILESO=C1C=C[C@@H]2CCCCN12
InChIInChI=1S/C8H11NO/c10-8-5-4-7-3-1-2-6-9(7)8/h4-5,7H,1-3,6H2/t7-/m0/s1
InChIKeyLFCFCWLFQIPDPF-ZETCQYMHSA-N
MW137.18 g/mol
LogP0.94
Rot. Bonds

About (8aS)-6,7,8,8a-tetrahydro-5H-indolizin-3-one

(8aS)-6,7,8,8a-tetrahydro-5H-indolizin-3-one (PubChem CID 10953577) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is (8aS)-6,7,8,8a-tetrahydro-5H-indolizin-3-one.

Molecular Properties

Compound Name(8aS)-6,7,8,8a-tetrahydro-5H-indolizin-3-one
PubChem CID10953577
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name(8aS)-6,7,8,8a-tetrahydro-5H-indolizin-3-one
SMILESO=C1C=C[C@@H]2CCCCN12
InChIInChI=1S/C8H11NO/c10-8-5-4-7-3-1-2-6-9(7)8/h4-5,7H,1-3,6H2/t7-/m0/s1
InChIKeyLFCFCWLFQIPDPF-ZETCQYMHSA-N
XLogP0.94
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 50.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (8aS)-6,7,8,8a-tetrahydro-5H-indolizin-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2E,4E,8Z)-1-piperidin-1-yltetradeca-2,4,8-trien-1-one
CID 11173777
2-Decen-1-one, 1-(1-piperidinyl)-, (2E)-
CID 10966538
(2E,4Z-Decadienoyl)piperidine
CID 21634287
Neopellitorine B
CID 11118018
2,4-Decadienoic acid piperidide
CID 73816694
(2E)-1-piperidin-1-yldeca-2,4-dien-1-one
CID 172863088
2,8a-Dimethyl-5,6,7,8-tetrahydroindolizin-3-one
CID 13331592
1-(Piperidin-1-yl)dec-2-en-1-one
CID 53427389
4H-Quinolizin-4-one, 1,6,7,8,9,9a-hexahydro-
CID 11457783
2-methyl-6,7,8,8a-tetrahydro-3(5H)-indolizinone
CID 13331588
2,5-dimethyl-6,7,8,8a-tetrahydro-5H-indolizin-3-one
CID 13331589
(E)-1-piperidin-1-ylnon-2-en-1-one
CID 12575257

Frequently Asked Questions

What is the IUPAC name of (8aS)-6,7,8,8a-tetrahydro-5H-indolizin-3-one?
The IUPAC name of (8aS)-6,7,8,8a-tetrahydro-5H-indolizin-3-one (CID 10953577) is (8aS)-6,7,8,8a-tetrahydro-5H-indolizin-3-one.
What is the SMILES notation for (8aS)-6,7,8,8a-tetrahydro-5H-indolizin-3-one?
The canonical SMILES for (8aS)-6,7,8,8a-tetrahydro-5H-indolizin-3-one is O=C1C=C[C@@H]2CCCCN12.
What is the InChIKey of (8aS)-6,7,8,8a-tetrahydro-5H-indolizin-3-one?
The InChIKey is LFCFCWLFQIPDPF-ZETCQYMHSA-N. The full InChI is InChI=1S/C8H11NO/c10-8-5-4-7-3-1-2-6-9(7)8/h4-5,7H,1-3,6H2/t7-/m0/s1.
What are the key properties of (8aS)-6,7,8,8a-tetrahydro-5H-indolizin-3-one?
(8aS)-6,7,8,8a-tetrahydro-5H-indolizin-3-one has a molecular weight of 137.18 g/mol, XLogP of 0.94, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (8aS)-6,7,8,8a-tetrahydro-5H-indolizin-3-one is sourced from PubChem (CID 10953577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).