3-ethyl-1-azabicyclo[5.2.0]nonane

C10H19N — CID 89423692

IUPAC3-ethyl-1-azabicyclo[5.2.0]nonane
SMILESCCC1CCCC2CCN2C1
InChIInChI=1S/C10H19N/c1-2-9-4-3-5-10-6-7-11(10)8-9/h9-10H,2-8H2,1H3
InChIKeyFDUIQEBHADFHJY-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.27
Rot. Bonds1

About 3-ethyl-1-azabicyclo[5.2.0]nonane

3-ethyl-1-azabicyclo[5.2.0]nonane (PubChem CID 89423692) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 3-ethyl-1-azabicyclo[5.2.0]nonane.

Molecular Properties

Compound Name3-ethyl-1-azabicyclo[5.2.0]nonane
PubChem CID89423692
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name3-ethyl-1-azabicyclo[5.2.0]nonane
SMILESCCC1CCCC2CCN2C1
InChIInChI=1S/C10H19N/c1-2-9-4-3-5-10-6-7-11(10)8-9/h9-10H,2-8H2,1H3
InChIKeyFDUIQEBHADFHJY-UHFFFAOYSA-N
XLogP2.27
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-azabicyclo[5.2.0]nonane?
The IUPAC name of 3-ethyl-1-azabicyclo[5.2.0]nonane (CID 89423692) is 3-ethyl-1-azabicyclo[5.2.0]nonane.
What is the SMILES notation for 3-ethyl-1-azabicyclo[5.2.0]nonane?
The canonical SMILES for 3-ethyl-1-azabicyclo[5.2.0]nonane is CCC1CCCC2CCN2C1.
What is the InChIKey of 3-ethyl-1-azabicyclo[5.2.0]nonane?
The InChIKey is FDUIQEBHADFHJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-2-9-4-3-5-10-6-7-11(10)8-9/h9-10H,2-8H2,1H3.
What are the key properties of 3-ethyl-1-azabicyclo[5.2.0]nonane?
3-ethyl-1-azabicyclo[5.2.0]nonane has a molecular weight of 153.27 g/mol, XLogP of 2.27, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-azabicyclo[5.2.0]nonane is sourced from PubChem (CID 89423692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).