9-[3-(dimethylamino)propyl]-9-azabicyclo[3.3.1]nonan-3-amine

C13H27N3 — CID 62712901

IUPAC9-[3-(dimethylamino)propyl]-9-azabicyclo[3.3.1]nonan-3-amine
SMILESCN(C)CCCN1C2CCCC1CC(N)C2
InChIInChI=1S/C13H27N3/c1-15(2)7-4-8-16-12-5-3-6-13(16)10-11(14)9-12/h11-13H,3-10,14H2,1-2H3
InChIKeyZTLAQXOFGBLBJE-UHFFFAOYSA-N
MW225.38 g/mol
LogP1.28
Rot. Bonds4

About 9-[3-(dimethylamino)propyl]-9-azabicyclo[3.3.1]nonan-3-amine

9-[3-(dimethylamino)propyl]-9-azabicyclo[3.3.1]nonan-3-amine (PubChem CID 62712901) has the molecular formula C13H27N3 and a molecular weight of 225.38 g/mol. Its IUPAC name is 9-[3-(dimethylamino)propyl]-9-azabicyclo[3.3.1]nonan-3-amine.

Molecular Properties

Compound Name9-[3-(dimethylamino)propyl]-9-azabicyclo[3.3.1]nonan-3-amine
PubChem CID62712901
Molecular FormulaC13H27N3
Molecular Weight225.38 g/mol
Exact Mass225.22
IUPAC Name9-[3-(dimethylamino)propyl]-9-azabicyclo[3.3.1]nonan-3-amine
SMILESCN(C)CCCN1C2CCCC1CC(N)C2
InChIInChI=1S/C13H27N3/c1-15(2)7-4-8-16-12-5-3-6-13(16)10-11(14)9-12/h11-13H,3-10,14H2,1-2H3
InChIKeyZTLAQXOFGBLBJE-UHFFFAOYSA-N
XLogP1.28
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 9-[3-(dimethylamino)propyl]-9-azabicyclo[3.3.1]nonan-3-amine 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 9-[3-(dimethylamino)propyl]-9-azabicyclo[3.3.1]nonan-3-amine?
The IUPAC name of 9-[3-(dimethylamino)propyl]-9-azabicyclo[3.3.1]nonan-3-amine (CID 62712901) is 9-[3-(dimethylamino)propyl]-9-azabicyclo[3.3.1]nonan-3-amine.
What is the SMILES notation for 9-[3-(dimethylamino)propyl]-9-azabicyclo[3.3.1]nonan-3-amine?
The canonical SMILES for 9-[3-(dimethylamino)propyl]-9-azabicyclo[3.3.1]nonan-3-amine is CN(C)CCCN1C2CCCC1CC(N)C2.
What is the InChIKey of 9-[3-(dimethylamino)propyl]-9-azabicyclo[3.3.1]nonan-3-amine?
The InChIKey is ZTLAQXOFGBLBJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3/c1-15(2)7-4-8-16-12-5-3-6-13(16)10-11(14)9-12/h11-13H,3-10,14H2,1-2H3.
What are the key properties of 9-[3-(dimethylamino)propyl]-9-azabicyclo[3.3.1]nonan-3-amine?
9-[3-(dimethylamino)propyl]-9-azabicyclo[3.3.1]nonan-3-amine has a molecular weight of 225.38 g/mol, XLogP of 1.28, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-(dimethylamino)propyl]-9-azabicyclo[3.3.1]nonan-3-amine is sourced from PubChem (CID 62712901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).