2,3,9-trimethyl-9-azabicyclo[3.3.1]nonane

C11H21N — CID 58019090

IUPAC2,3,9-trimethyl-9-azabicyclo[3.3.1]nonane
SMILESCC1CC2CCCC(C1C)N2C
InChIInChI=1S/C11H21N/c1-8-7-10-5-4-6-11(9(8)2)12(10)3/h8-11H,4-7H2,1-3H3
InChIKeyDWJFCNLTWUJQFW-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.52
Rot. Bonds

About 2,3,9-trimethyl-9-azabicyclo[3.3.1]nonane

2,3,9-trimethyl-9-azabicyclo[3.3.1]nonane (PubChem CID 58019090) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 2,3,9-trimethyl-9-azabicyclo[3.3.1]nonane.

Molecular Properties

Compound Name2,3,9-trimethyl-9-azabicyclo[3.3.1]nonane
PubChem CID58019090
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name2,3,9-trimethyl-9-azabicyclo[3.3.1]nonane
SMILESCC1CC2CCCC(C1C)N2C
InChIInChI=1S/C11H21N/c1-8-7-10-5-4-6-11(9(8)2)12(10)3/h8-11H,4-7H2,1-3H3
InChIKeyDWJFCNLTWUJQFW-UHFFFAOYSA-N
XLogP2.52
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2,3,9-trimethyl-9-azabicyclo[3.3.1]nonane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,3,9-trimethyl-9-azabicyclo[3.3.1]nonane?
The IUPAC name of 2,3,9-trimethyl-9-azabicyclo[3.3.1]nonane (CID 58019090) is 2,3,9-trimethyl-9-azabicyclo[3.3.1]nonane.
What is the SMILES notation for 2,3,9-trimethyl-9-azabicyclo[3.3.1]nonane?
The canonical SMILES for 2,3,9-trimethyl-9-azabicyclo[3.3.1]nonane is CC1CC2CCCC(C1C)N2C.
What is the InChIKey of 2,3,9-trimethyl-9-azabicyclo[3.3.1]nonane?
The InChIKey is DWJFCNLTWUJQFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-8-7-10-5-4-6-11(9(8)2)12(10)3/h8-11H,4-7H2,1-3H3.
What are the key properties of 2,3,9-trimethyl-9-azabicyclo[3.3.1]nonane?
2,3,9-trimethyl-9-azabicyclo[3.3.1]nonane has a molecular weight of 167.30 g/mol, XLogP of 2.52, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,9-trimethyl-9-azabicyclo[3.3.1]nonane is sourced from PubChem (CID 58019090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).