(4R)-1-azabicyclo[3.3.1]nonan-4-amine

C8H16N2 — CID 14502093

IUPAC(4R)-1-azabicyclo[3.3.1]nonan-4-amine
SMILESN[C@@H]1CCN2CCCC1C2
InChIInChI=1S/C8H16N2/c9-8-3-5-10-4-1-2-7(8)6-10/h7-8H,1-6,9H2/t7?,8-/m1/s1
InChIKeyVIZAZBTVZGLWCG-BRFYHDHCSA-N
MW140.23 g/mol
LogP0.43
Rot. Bonds

About (4R)-1-azabicyclo[3.3.1]nonan-4-amine

(4R)-1-azabicyclo[3.3.1]nonan-4-amine (PubChem CID 14502093) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (4R)-1-azabicyclo[3.3.1]nonan-4-amine.

Molecular Properties

Compound Name(4R)-1-azabicyclo[3.3.1]nonan-4-amine
PubChem CID14502093
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(4R)-1-azabicyclo[3.3.1]nonan-4-amine
SMILESN[C@@H]1CCN2CCCC1C2
InChIInChI=1S/C8H16N2/c9-8-3-5-10-4-1-2-7(8)6-10/h7-8H,1-6,9H2/t7?,8-/m1/s1
InChIKeyVIZAZBTVZGLWCG-BRFYHDHCSA-N
XLogP0.43
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4R)-1-azabicyclo[3.3.1]nonan-4-amine?
The IUPAC name of (4R)-1-azabicyclo[3.3.1]nonan-4-amine (CID 14502093) is (4R)-1-azabicyclo[3.3.1]nonan-4-amine.
What is the SMILES notation for (4R)-1-azabicyclo[3.3.1]nonan-4-amine?
The canonical SMILES for (4R)-1-azabicyclo[3.3.1]nonan-4-amine is N[C@@H]1CCN2CCCC1C2.
What is the InChIKey of (4R)-1-azabicyclo[3.3.1]nonan-4-amine?
The InChIKey is VIZAZBTVZGLWCG-BRFYHDHCSA-N. The full InChI is InChI=1S/C8H16N2/c9-8-3-5-10-4-1-2-7(8)6-10/h7-8H,1-6,9H2/t7?,8-/m1/s1.
What are the key properties of (4R)-1-azabicyclo[3.3.1]nonan-4-amine?
(4R)-1-azabicyclo[3.3.1]nonan-4-amine has a molecular weight of 140.23 g/mol, XLogP of 0.43, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1-azabicyclo[3.3.1]nonan-4-amine is sourced from PubChem (CID 14502093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).