6-ethyl-6-azabicyclo[3.2.0]heptane

C8H15N — CID 70673038

IUPAC6-ethyl-6-azabicyclo[3.2.0]heptane
SMILESCCN1CC2CCCC21
InChIInChI=1S/C8H15N/c1-2-9-6-7-4-3-5-8(7)9/h7-8H,2-6H2,1H3
InChIKeyZHVAMMXGDMIGIU-UHFFFAOYSA-N
MW125.22 g/mol
LogP1.49
Rot. Bonds1

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

6-ethyl-6-azabicyclo[3.2.0]heptane (PubChem CID 70673038) has the molecular formula C8H15N and a molecular weight of 125.22 g/mol. Its IUPAC name is 6-ethyl-6-azabicyclo[3.2.0]heptane.

Molecular Properties

Compound Name6-ethyl-6-azabicyclo[3.2.0]heptane
PubChem CID70673038
Molecular FormulaC8H15N
Molecular Weight125.22 g/mol
Exact Mass125.12
IUPAC Name6-ethyl-6-azabicyclo[3.2.0]heptane
SMILESCCN1CC2CCCC21
InChIInChI=1S/C8H15N/c1-2-9-6-7-4-3-5-8(7)9/h7-8H,2-6H2,1H3
InChIKeyZHVAMMXGDMIGIU-UHFFFAOYSA-N
XLogP1.49
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.22
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(1R,6R)-7-ethyl-7-azabicyclo[4.2.0]octane
CID 130709044
9-propyl-9-azabicyclo[6.2.0]decane
CID 126990839
1-ethyl-2,3,3a,4,5,6,7,7a-octahydroindole
CID 524515
(2R)-1-(6-azabicyclo[3.2.0]heptan-6-yl)propan-2-amine;dihydrochloride
CID 122669519
6-(2,2-difluoroethyl)-6-azabicyclo[3.2.0]heptane
CID 130685379
2-(6-azabicyclo[3.2.0]heptan-6-yl)acetic acid
CID 127019883
(1R,6R)-7-(2-fluoroethyl)-7-azabicyclo[4.2.0]octane
CID 130978927
6-azabicyclo[3.2.0]heptan-6-amine
CID 77464035
2-ethyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 21427660
7-(3-methylbut-3-enyl)-7-azabicyclo[4.2.0]octane
CID 130628784
3-(6-azabicyclo[3.2.0]heptan-6-yl)propanoic acid;hydrochloride
CID 130695692
9-prop-2-ynyl-9-azabicyclo[6.2.0]decane
CID 130688640

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-6-azabicyclo[3.2.0]heptane?
The IUPAC name of 6-ethyl-6-azabicyclo[3.2.0]heptane (CID 70673038) is 6-ethyl-6-azabicyclo[3.2.0]heptane.
What is the SMILES notation for 6-ethyl-6-azabicyclo[3.2.0]heptane?
The canonical SMILES for 6-ethyl-6-azabicyclo[3.2.0]heptane is CCN1CC2CCCC21.
What is the InChIKey of 6-ethyl-6-azabicyclo[3.2.0]heptane?
The InChIKey is ZHVAMMXGDMIGIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N/c1-2-9-6-7-4-3-5-8(7)9/h7-8H,2-6H2,1H3.
What are the key properties of 6-ethyl-6-azabicyclo[3.2.0]heptane?
6-ethyl-6-azabicyclo[3.2.0]heptane has a molecular weight of 125.22 g/mol, XLogP of 1.49, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-6-azabicyclo[3.2.0]heptane is sourced from PubChem (CID 70673038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).