7-ethyl-6-azabicyclo[3.2.0]heptane

C8H15N — CID 153054846

IUPAC7-ethyl-6-azabicyclo[3.2.0]heptane
SMILESCCC1NC2CCCC12
InChIInChI=1S/C8H15N/c1-2-7-6-4-3-5-8(6)9-7/h6-9H,2-5H2,1H3
InChIKeyVIGXGQAAIOFKFG-UHFFFAOYSA-N
MW125.22 g/mol
LogP1.54
Rot. Bonds1

About 7-ethyl-6-azabicyclo[3.2.0]heptane

7-ethyl-6-azabicyclo[3.2.0]heptane (PubChem CID 153054846) has the molecular formula C8H15N and a molecular weight of 125.22 g/mol. Its IUPAC name is 7-ethyl-6-azabicyclo[3.2.0]heptane.

Molecular Properties

Compound Name7-ethyl-6-azabicyclo[3.2.0]heptane
PubChem CID153054846
Molecular FormulaC8H15N
Molecular Weight125.22 g/mol
Exact Mass125.12
IUPAC Name7-ethyl-6-azabicyclo[3.2.0]heptane
SMILESCCC1NC2CCCC12
InChIInChI=1S/C8H15N/c1-2-7-6-4-3-5-8(6)9-7/h6-9H,2-5H2,1H3
InChIKeyVIGXGQAAIOFKFG-UHFFFAOYSA-N
XLogP1.54
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.22
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-ethyl-6-azabicyclo[3.2.0]heptane?
The IUPAC name of 7-ethyl-6-azabicyclo[3.2.0]heptane (CID 153054846) is 7-ethyl-6-azabicyclo[3.2.0]heptane.
What is the SMILES notation for 7-ethyl-6-azabicyclo[3.2.0]heptane?
The canonical SMILES for 7-ethyl-6-azabicyclo[3.2.0]heptane is CCC1NC2CCCC12.
What is the InChIKey of 7-ethyl-6-azabicyclo[3.2.0]heptane?
The InChIKey is VIGXGQAAIOFKFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N/c1-2-7-6-4-3-5-8(6)9-7/h6-9H,2-5H2,1H3.
What are the key properties of 7-ethyl-6-azabicyclo[3.2.0]heptane?
7-ethyl-6-azabicyclo[3.2.0]heptane has a molecular weight of 125.22 g/mol, XLogP of 1.54, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-6-azabicyclo[3.2.0]heptane is sourced from PubChem (CID 153054846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).