6-azatetracyclo[6.3.1.03,10.05,10]dodecane

C11H17N — CID 163941140

IUPAC6-azatetracyclo[6.3.1.03,10.05,10]dodecane
SMILESC1NC2CC3CC4CC1CC32C4
InChIInChI=1S/C11H17N/c1-7-2-9-3-10-11(9,4-7)5-8(1)6-12-10/h7-10,12H,1-6H2
InChIKeyRRAXQDLGDPCRLF-UHFFFAOYSA-N
MW163.26 g/mol
LogP1.78
Rot. Bonds

About 6-azatetracyclo[6.3.1.03,10.05,10]dodecane

6-azatetracyclo[6.3.1.03,10.05,10]dodecane (PubChem CID 163941140) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is 6-azatetracyclo[6.3.1.03,10.05,10]dodecane.

Molecular Properties

Compound Name6-azatetracyclo[6.3.1.03,10.05,10]dodecane
PubChem CID163941140
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name6-azatetracyclo[6.3.1.03,10.05,10]dodecane
SMILESC1NC2CC3CC4CC1CC32C4
InChIInChI=1S/C11H17N/c1-7-2-9-3-10-11(9,4-7)5-8(1)6-12-10/h7-10,12H,1-6H2
InChIKeyRRAXQDLGDPCRLF-UHFFFAOYSA-N
XLogP1.78
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-azatetracyclo[6.3.1.03,10.05,10]dodecane?
The IUPAC name of 6-azatetracyclo[6.3.1.03,10.05,10]dodecane (CID 163941140) is 6-azatetracyclo[6.3.1.03,10.05,10]dodecane.
What is the SMILES notation for 6-azatetracyclo[6.3.1.03,10.05,10]dodecane?
The canonical SMILES for 6-azatetracyclo[6.3.1.03,10.05,10]dodecane is C1NC2CC3CC4CC1CC32C4.
What is the InChIKey of 6-azatetracyclo[6.3.1.03,10.05,10]dodecane?
The InChIKey is RRAXQDLGDPCRLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N/c1-7-2-9-3-10-11(9,4-7)5-8(1)6-12-10/h7-10,12H,1-6H2.
What are the key properties of 6-azatetracyclo[6.3.1.03,10.05,10]dodecane?
6-azatetracyclo[6.3.1.03,10.05,10]dodecane has a molecular weight of 163.26 g/mol, XLogP of 1.78, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-azatetracyclo[6.3.1.03,10.05,10]dodecane is sourced from PubChem (CID 163941140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).