5-ethyl-1-azatricyclo[5.2.1.02,6]decane

C11H19N — CID 54182605

IUPAC5-ethyl-1-azatricyclo[5.2.1.02,6]decane
SMILESCCC1CCC2C1C1CCN2C1
InChIInChI=1S/C11H19N/c1-2-8-3-4-10-11(8)9-5-6-12(10)7-9/h8-11H,2-7H2,1H3
InChIKeyPCWJYCUBRLEOIS-UHFFFAOYSA-N
MW165.28 g/mol
LogP2.13
Rot. Bonds1

About 5-ethyl-1-azatricyclo[5.2.1.02,6]decane

5-ethyl-1-azatricyclo[5.2.1.02,6]decane (PubChem CID 54182605) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 5-ethyl-1-azatricyclo[5.2.1.02,6]decane.

Molecular Properties

Compound Name5-ethyl-1-azatricyclo[5.2.1.02,6]decane
PubChem CID54182605
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name5-ethyl-1-azatricyclo[5.2.1.02,6]decane
SMILESCCC1CCC2C1C1CCN2C1
InChIInChI=1S/C11H19N/c1-2-8-3-4-10-11(8)9-5-6-12(10)7-9/h8-11H,2-7H2,1H3
InChIKeyPCWJYCUBRLEOIS-UHFFFAOYSA-N
XLogP2.13
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 ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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1-(2,4-dimethylcyclohexyl)-3-ethylpiperidin-4-amine
CID 81458379
(2S,4S,5R)-5-ethyl-2-(iodomethyl)-1-azabicyclo[2.2.2]octane
CID 101047368
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trans-(1R,2R)-1,2-diethylcyclobutane
CID 59110889
1-(2-ethylcyclohexyl)-N-methylpyrrolidin-3-amine
CID 61470287
(3R,4S)-1-cyclopropyl-4-ethyl-3-methylpiperidine
CID 134195657
6-[[8-(1-azabicyclo[3.2.1]octan-2-yl)-2-azabicyclo[3.2.1]octan-2-yl]methyl]-2-methyl-2-azabicyclo[2.2.2]octane
CID 167174300
5,6-diethyl-2,3-dimethyl-1-azabicyclo[5.2.2]undecane
CID 155306953
5-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-ethyl-2,2-dimethylcyclopentan-1-amine
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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1-azatricyclo[5.2.1.02,6]decane?
The IUPAC name of 5-ethyl-1-azatricyclo[5.2.1.02,6]decane (CID 54182605) is 5-ethyl-1-azatricyclo[5.2.1.02,6]decane.
What is the SMILES notation for 5-ethyl-1-azatricyclo[5.2.1.02,6]decane?
The canonical SMILES for 5-ethyl-1-azatricyclo[5.2.1.02,6]decane is CCC1CCC2C1C1CCN2C1.
What is the InChIKey of 5-ethyl-1-azatricyclo[5.2.1.02,6]decane?
The InChIKey is PCWJYCUBRLEOIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c1-2-8-3-4-10-11(8)9-5-6-12(10)7-9/h8-11H,2-7H2,1H3.
What are the key properties of 5-ethyl-1-azatricyclo[5.2.1.02,6]decane?
5-ethyl-1-azatricyclo[5.2.1.02,6]decane has a molecular weight of 165.28 g/mol, XLogP of 2.13, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1-azatricyclo[5.2.1.02,6]decane is sourced from PubChem (CID 54182605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).