1-ethyl-2,3,4,6,7,8-hexahydro-1H-quinolizine

C11H19N — CID 134894503

IUPAC1-ethyl-2,3,4,6,7,8-hexahydro-1H-quinolizine
SMILESCCC1CCCN2CCCC=C12
InChIInChI=1S/C11H19N/c1-2-10-6-5-9-12-8-4-3-7-11(10)12/h7,10H,2-6,8-9H2,1H3
InChIKeyBQASNYNLXKGILB-UHFFFAOYSA-N
MW165.28 g/mol
LogP2.79
Rot. Bonds1

About 1-ethyl-2,3,4,6,7,8-hexahydro-1H-quinolizine

1-ethyl-2,3,4,6,7,8-hexahydro-1H-quinolizine (PubChem CID 134894503) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 1-ethyl-2,3,4,6,7,8-hexahydro-1H-quinolizine.

Molecular Properties

Compound Name1-ethyl-2,3,4,6,7,8-hexahydro-1H-quinolizine
PubChem CID134894503
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name1-ethyl-2,3,4,6,7,8-hexahydro-1H-quinolizine
SMILESCCC1CCCN2CCCC=C12
InChIInChI=1S/C11H19N/c1-2-10-6-5-9-12-8-4-3-7-11(10)12/h7,10H,2-6,8-9H2,1H3
InChIKeyBQASNYNLXKGILB-UHFFFAOYSA-N
XLogP2.79
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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1-((r,s)-6-Methyl-cyclohex-1-enyl)-piperidine
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N,N-bis(2-methylpropyl)cyclohexen-1-amine
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1-(6-Prop-1-en-2-ylcyclohex-2-en-1-yl)piperidine
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N,N,6-trimethylcyclohexen-1-amine
CID 12664021
1-(4,4-Dimethylcyclohexen-1-yl)piperidine
CID 13827862
N,N,4-trimethylcyclohexen-1-amine
CID 14318945
1-(3,3,5,5-Tetramethylcyclohex-1-en-1-yl)piperidine
CID 14892748
1-methyl-3,4,4a,5,6,7-hexahydro-2H-quinoline
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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2,3,4,6,7,8-hexahydro-1H-quinolizine?
The IUPAC name of 1-ethyl-2,3,4,6,7,8-hexahydro-1H-quinolizine (CID 134894503) is 1-ethyl-2,3,4,6,7,8-hexahydro-1H-quinolizine.
What is the SMILES notation for 1-ethyl-2,3,4,6,7,8-hexahydro-1H-quinolizine?
The canonical SMILES for 1-ethyl-2,3,4,6,7,8-hexahydro-1H-quinolizine is CCC1CCCN2CCCC=C12.
What is the InChIKey of 1-ethyl-2,3,4,6,7,8-hexahydro-1H-quinolizine?
The InChIKey is BQASNYNLXKGILB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c1-2-10-6-5-9-12-8-4-3-7-11(10)12/h7,10H,2-6,8-9H2,1H3.
What are the key properties of 1-ethyl-2,3,4,6,7,8-hexahydro-1H-quinolizine?
1-ethyl-2,3,4,6,7,8-hexahydro-1H-quinolizine has a molecular weight of 165.28 g/mol, XLogP of 2.79, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2,3,4,6,7,8-hexahydro-1H-quinolizine is sourced from PubChem (CID 134894503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).