8-azabicyclo[3.2.1]octan-8-ylmethanimine

C8H14N2 — CID 148703313

IUPAC8-azabicyclo[3.2.1]octan-8-ylmethanimine
SMILES[H]/N=C/N1C2CCCC1CC2
InChIInChI=1S/C8H14N2/c9-6-10-7-2-1-3-8(10)5-4-7/h6-9H,1-5H2/b9-6+
InChIKeyNVUDIRPIGHAEIJ-RMKNXTFCSA-N
MW138.21 g/mol
LogP1.61
Rot. Bonds1

About 8-azabicyclo[3.2.1]octan-8-ylmethanimine

8-azabicyclo[3.2.1]octan-8-ylmethanimine (PubChem CID 148703313) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 8-azabicyclo[3.2.1]octan-8-ylmethanimine.

Molecular Properties

Compound Name8-azabicyclo[3.2.1]octan-8-ylmethanimine
PubChem CID148703313
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name8-azabicyclo[3.2.1]octan-8-ylmethanimine
SMILES[H]/N=C/N1C2CCCC1CC2
InChIInChI=1S/C8H14N2/c9-6-10-7-2-1-3-8(10)5-4-7/h6-9H,1-5H2/b9-6+
InChIKeyNVUDIRPIGHAEIJ-RMKNXTFCSA-N
XLogP1.61
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 8-azabicyclo[3.2.1]octan-8-ylmethanimine?
The IUPAC name of 8-azabicyclo[3.2.1]octan-8-ylmethanimine (CID 148703313) is 8-azabicyclo[3.2.1]octan-8-ylmethanimine.
What is the SMILES notation for 8-azabicyclo[3.2.1]octan-8-ylmethanimine?
The canonical SMILES for 8-azabicyclo[3.2.1]octan-8-ylmethanimine is [H]/N=C/N1C2CCCC1CC2.
What is the InChIKey of 8-azabicyclo[3.2.1]octan-8-ylmethanimine?
The InChIKey is NVUDIRPIGHAEIJ-RMKNXTFCSA-N. The full InChI is InChI=1S/C8H14N2/c9-6-10-7-2-1-3-8(10)5-4-7/h6-9H,1-5H2/b9-6+.
What are the key properties of 8-azabicyclo[3.2.1]octan-8-ylmethanimine?
8-azabicyclo[3.2.1]octan-8-ylmethanimine has a molecular weight of 138.21 g/mol, XLogP of 1.61, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-azabicyclo[3.2.1]octan-8-ylmethanimine is sourced from PubChem (CID 148703313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).