7-azatricyclo[5.3.0.04,8]decane

C9H15N — CID 91155902

IUPAC7-azatricyclo[5.3.0.04,8]decane
SMILESC1CC2CCC3C1CCN23
InChIInChI=1S/C9H15N/c1-2-8-3-4-9-7(1)5-6-10(8)9/h7-9H,1-6H2
InChIKeyLCDBMHHGWMXMLB-UHFFFAOYSA-N
MW137.23 g/mol
LogP1.63
Rot. Bonds

About 7-azatricyclo[5.3.0.04,8]decane

7-azatricyclo[5.3.0.04,8]decane (PubChem CID 91155902) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is 7-azatricyclo[5.3.0.04,8]decane.

Molecular Properties

Compound Name7-azatricyclo[5.3.0.04,8]decane
PubChem CID91155902
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name7-azatricyclo[5.3.0.04,8]decane
SMILESC1CC2CCC3C1CCN23
InChIInChI=1S/C9H15N/c1-2-8-3-4-9-7(1)5-6-10(8)9/h7-9H,1-6H2
InChIKeyLCDBMHHGWMXMLB-UHFFFAOYSA-N
XLogP1.63
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 7-azatricyclo[5.3.0.04,8]decane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-Ethyl-1-azabicyclo[3.2.1]octane
CID 18765862
1-Azatricyclo[8.2.1.02,8]tridecane
CID 53795995
3,4,5,5-Tetramethyl-7-azatricyclo[5.3.0.04,8]decane
CID 53887060
10-Azatricyclo[8.2.1.02,8]tridecane
CID 53994694
7,9-Dimethyl-9-azatricyclo[4.2.1.12,5]decane
CID 57115490
9-Ethyl-9-azatricyclo[4.2.1.12,5]decane
CID 57172667
2-Azatricyclo[5.3.2.02,6]dodecane
CID 57261397
9-Methyl-9-azatricyclo[4.2.1.12,5]decane
CID 57288268
CID 58281298
CID 58281298
3-(1-Azabicyclo[3.2.1]octan-2-yl)-8-methyl-8-azabicyclo[3.2.1]octane
CID 66793174
3,8-Dimethyl-8-azabicyclo[3.2.1]octane;3-methyl-1-azabicyclo[3.2.1]octane
CID 160692639
3,8-Dimethyl-8-azabicyclo[3.2.1]octane;methane;3-methyl-1-azabicyclo[3.2.1]octane
CID 161224819

Frequently Asked Questions

What is the IUPAC name of 7-azatricyclo[5.3.0.04,8]decane?
The IUPAC name of 7-azatricyclo[5.3.0.04,8]decane (CID 91155902) is 7-azatricyclo[5.3.0.04,8]decane.
What is the SMILES notation for 7-azatricyclo[5.3.0.04,8]decane?
The canonical SMILES for 7-azatricyclo[5.3.0.04,8]decane is C1CC2CCC3C1CCN23.
What is the InChIKey of 7-azatricyclo[5.3.0.04,8]decane?
The InChIKey is LCDBMHHGWMXMLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N/c1-2-8-3-4-9-7(1)5-6-10(8)9/h7-9H,1-6H2.
What are the key properties of 7-azatricyclo[5.3.0.04,8]decane?
7-azatricyclo[5.3.0.04,8]decane has a molecular weight of 137.23 g/mol, XLogP of 1.63, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-azatricyclo[5.3.0.04,8]decane is sourced from PubChem (CID 91155902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).