3,5-dimethyl-1-azatricyclo[3.3.1.13,7]decane

C11H19N — CID 14973196

IUPAC3,5-dimethyl-1-azatricyclo[3.3.1.13,7]decane
SMILESCC12CC3CN(C1)CC(C)(C3)C2
InChIInChI=1S/C11H19N/c1-10-3-9-4-11(2,6-10)8-12(5-9)7-10/h9H,3-8H2,1-2H3
InChIKeyUSAAHRDLZOZFAC-UHFFFAOYSA-N
MW165.28 g/mol
LogP2.13
Rot. Bonds

About 3,5-dimethyl-1-azatricyclo[3.3.1.13,7]decane

3,5-dimethyl-1-azatricyclo[3.3.1.13,7]decane (PubChem CID 14973196) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 3,5-dimethyl-1-azatricyclo[3.3.1.13,7]decane.

Molecular Properties

Compound Name3,5-dimethyl-1-azatricyclo[3.3.1.13,7]decane
PubChem CID14973196
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name3,5-dimethyl-1-azatricyclo[3.3.1.13,7]decane
SMILESCC12CC3CN(C1)CC(C)(C3)C2
InChIInChI=1S/C11H19N/c1-10-3-9-4-11(2,6-10)8-12(5-9)7-10/h9H,3-8H2,1-2H3
InChIKeyUSAAHRDLZOZFAC-UHFFFAOYSA-N
XLogP2.13
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 ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-Azatricyclo(3.3.1.13,7)decane
CID 136106
2,2,6,6-Tetramethyl-1-azabicyclo[2.2.2]octane
CID 160186
3,5,7-Trimethyl-1-azatricyclo[3.3.1.13,7]decane
CID 4702161
Methyl-aza-adamantane
CID 14973198
2,2-Dimethyl-1-azaadamantane
CID 14973201
1-Azabicyclo(2.2.2)octane, 4-(1-methylethyl)-
CID 142667
1,2,2,6,6-Pentamethyl-1-azoniabicyclo[2.2.2]octane
CID 162047
1-Methyl-1-azoniatricyclo[3.3.1.13,7]decane
CID 12330681
5-Methyl-1-azatricyclo[3.3.1.13,7]decane-3-carbonitrile
CID 15723746
1-Propan-2-yl-1-azoniatricyclo[3.3.1.13,7]decane
CID 12330687
2-Propan-2-yl-1-azabicyclo[2.2.2]octane
CID 18727324
2-Tert-butyl-1-azabicyclo[2.2.2]octane
CID 20628470

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-1-azatricyclo[3.3.1.13,7]decane?
The IUPAC name of 3,5-dimethyl-1-azatricyclo[3.3.1.13,7]decane (CID 14973196) is 3,5-dimethyl-1-azatricyclo[3.3.1.13,7]decane.
What is the SMILES notation for 3,5-dimethyl-1-azatricyclo[3.3.1.13,7]decane?
The canonical SMILES for 3,5-dimethyl-1-azatricyclo[3.3.1.13,7]decane is CC12CC3CN(C1)CC(C)(C3)C2.
What is the InChIKey of 3,5-dimethyl-1-azatricyclo[3.3.1.13,7]decane?
The InChIKey is USAAHRDLZOZFAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c1-10-3-9-4-11(2,6-10)8-12(5-9)7-10/h9H,3-8H2,1-2H3.
What are the key properties of 3,5-dimethyl-1-azatricyclo[3.3.1.13,7]decane?
3,5-dimethyl-1-azatricyclo[3.3.1.13,7]decane has a molecular weight of 165.28 g/mol, XLogP of 2.13, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-1-azatricyclo[3.3.1.13,7]decane is sourced from PubChem (CID 14973196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).