2-azatricyclo[5.2.2.01,4]undecane

C10H17N — CID 169095034

IUPAC2-azatricyclo[5.2.2.01,4]undecane
SMILESC1CC2CNC23CCC1CC3
InChIInChI=1S/C10H17N/c1-2-9-7-11-10(9)5-3-8(1)4-6-10/h8-9,11H,1-7H2
InChIKeyZFCHNRPAMHOERQ-UHFFFAOYSA-N
MW151.25 g/mol
LogP1.93
Rot. Bonds

About 2-azatricyclo[5.2.2.01,4]undecane

2-azatricyclo[5.2.2.01,4]undecane (PubChem CID 169095034) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 2-azatricyclo[5.2.2.01,4]undecane.

Molecular Properties

Compound Name2-azatricyclo[5.2.2.01,4]undecane
PubChem CID169095034
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name2-azatricyclo[5.2.2.01,4]undecane
SMILESC1CC2CNC23CCC1CC3
InChIInChI=1S/C10H17N/c1-2-9-7-11-10(9)5-3-8(1)4-6-10/h8-9,11H,1-7H2
InChIKeyZFCHNRPAMHOERQ-UHFFFAOYSA-N
XLogP1.93
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-azatricyclo[5.2.2.01,4]undecane?
The IUPAC name of 2-azatricyclo[5.2.2.01,4]undecane (CID 169095034) is 2-azatricyclo[5.2.2.01,4]undecane.
What is the SMILES notation for 2-azatricyclo[5.2.2.01,4]undecane?
The canonical SMILES for 2-azatricyclo[5.2.2.01,4]undecane is C1CC2CNC23CCC1CC3.
What is the InChIKey of 2-azatricyclo[5.2.2.01,4]undecane?
The InChIKey is ZFCHNRPAMHOERQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-2-9-7-11-10(9)5-3-8(1)4-6-10/h8-9,11H,1-7H2.
What are the key properties of 2-azatricyclo[5.2.2.01,4]undecane?
2-azatricyclo[5.2.2.01,4]undecane has a molecular weight of 151.25 g/mol, XLogP of 1.93, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azatricyclo[5.2.2.01,4]undecane is sourced from PubChem (CID 169095034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).