2-azatricyclo[7.3.0.03,7]dodecane

C11H19N — CID 14195049

IUPAC2-azatricyclo[7.3.0.03,7]dodecane
SMILESC1CC2CC3CCCC3NC2C1
InChIInChI=1S/C11H19N/c1-3-8-7-9-4-2-6-11(9)12-10(8)5-1/h8-12H,1-7H2
InChIKeyVNUGHTLCQCOTMJ-UHFFFAOYSA-N
MW165.28 g/mol
LogP2.32
Rot. Bonds

About 2-azatricyclo[7.3.0.03,7]dodecane

2-azatricyclo[7.3.0.03,7]dodecane (PubChem CID 14195049) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 2-azatricyclo[7.3.0.03,7]dodecane.

Molecular Properties

Compound Name2-azatricyclo[7.3.0.03,7]dodecane
PubChem CID14195049
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name2-azatricyclo[7.3.0.03,7]dodecane
SMILESC1CC2CC3CCCC3NC2C1
InChIInChI=1S/C11H19N/c1-3-8-7-9-4-2-6-11(9)12-10(8)5-1/h8-12H,1-7H2
InChIKeyVNUGHTLCQCOTMJ-UHFFFAOYSA-N
XLogP2.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-azatricyclo[7.3.0.03,7]dodecane?
The IUPAC name of 2-azatricyclo[7.3.0.03,7]dodecane (CID 14195049) is 2-azatricyclo[7.3.0.03,7]dodecane.
What is the SMILES notation for 2-azatricyclo[7.3.0.03,7]dodecane?
The canonical SMILES for 2-azatricyclo[7.3.0.03,7]dodecane is C1CC2CC3CCCC3NC2C1.
What is the InChIKey of 2-azatricyclo[7.3.0.03,7]dodecane?
The InChIKey is VNUGHTLCQCOTMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c1-3-8-7-9-4-2-6-11(9)12-10(8)5-1/h8-12H,1-7H2.
What are the key properties of 2-azatricyclo[7.3.0.03,7]dodecane?
2-azatricyclo[7.3.0.03,7]dodecane has a molecular weight of 165.28 g/mol, XLogP of 2.32, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azatricyclo[7.3.0.03,7]dodecane is sourced from PubChem (CID 14195049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).