4,6-dimethyl-2-azatricyclo[5.2.1.02,6]decane

C11H19N — CID 57319846

IUPAC4,6-dimethyl-2-azatricyclo[5.2.1.02,6]decane
SMILESCC1CN2C3CCC(C3)C2(C)C1
InChIInChI=1S/C11H19N/c1-8-6-11(2)9-3-4-10(5-9)12(11)7-8/h8-10H,3-7H2,1-2H3
InChIKeyOSILJDPPVBVKGN-UHFFFAOYSA-N
MW165.28 g/mol
LogP2.27
Rot. Bonds

About 4,6-dimethyl-2-azatricyclo[5.2.1.02,6]decane

4,6-dimethyl-2-azatricyclo[5.2.1.02,6]decane (PubChem CID 57319846) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 4,6-dimethyl-2-azatricyclo[5.2.1.02,6]decane.

Molecular Properties

Compound Name4,6-dimethyl-2-azatricyclo[5.2.1.02,6]decane
PubChem CID57319846
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name4,6-dimethyl-2-azatricyclo[5.2.1.02,6]decane
SMILESCC1CN2C3CCC(C3)C2(C)C1
InChIInChI=1S/C11H19N/c1-8-6-11(2)9-3-4-10(5-9)12(11)7-8/h8-10H,3-7H2,1-2H3
InChIKeyOSILJDPPVBVKGN-UHFFFAOYSA-N
XLogP2.27
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-2-azatricyclo[5.2.1.02,6]decane?
The IUPAC name of 4,6-dimethyl-2-azatricyclo[5.2.1.02,6]decane (CID 57319846) is 4,6-dimethyl-2-azatricyclo[5.2.1.02,6]decane.
What is the SMILES notation for 4,6-dimethyl-2-azatricyclo[5.2.1.02,6]decane?
The canonical SMILES for 4,6-dimethyl-2-azatricyclo[5.2.1.02,6]decane is CC1CN2C3CCC(C3)C2(C)C1.
What is the InChIKey of 4,6-dimethyl-2-azatricyclo[5.2.1.02,6]decane?
The InChIKey is OSILJDPPVBVKGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c1-8-6-11(2)9-3-4-10(5-9)12(11)7-8/h8-10H,3-7H2,1-2H3.
What are the key properties of 4,6-dimethyl-2-azatricyclo[5.2.1.02,6]decane?
4,6-dimethyl-2-azatricyclo[5.2.1.02,6]decane has a molecular weight of 165.28 g/mol, XLogP of 2.27, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-2-azatricyclo[5.2.1.02,6]decane is sourced from PubChem (CID 57319846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).