(1R,4R,6R)-2-azabicyclo[4.2.1]nonan-4-amine

C8H16N2 — CID 155155417

IUPAC(1R,4R,6R)-2-azabicyclo[4.2.1]nonan-4-amine
SMILESN[C@H]1CN[C@@H]2CC[C@H](C1)C2
InChIInChI=1S/C8H16N2/c9-7-3-6-1-2-8(4-6)10-5-7/h6-8,10H,1-5,9H2/t6-,7-,8-/m1/s1
InChIKeyOAXLCXGAYOENHB-BWZBUEFSSA-N
MW140.23 g/mol
LogP0.48
Rot. Bonds

About (1R,4R,6R)-2-azabicyclo[4.2.1]nonan-4-amine

(1R,4R,6R)-2-azabicyclo[4.2.1]nonan-4-amine (PubChem CID 155155417) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (1R,4R,6R)-2-azabicyclo[4.2.1]nonan-4-amine.

Molecular Properties

Compound Name(1R,4R,6R)-2-azabicyclo[4.2.1]nonan-4-amine
PubChem CID155155417
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(1R,4R,6R)-2-azabicyclo[4.2.1]nonan-4-amine
SMILESN[C@H]1CN[C@@H]2CC[C@H](C1)C2
InChIInChI=1S/C8H16N2/c9-7-3-6-1-2-8(4-6)10-5-7/h6-8,10H,1-5,9H2/t6-,7-,8-/m1/s1
InChIKeyOAXLCXGAYOENHB-BWZBUEFSSA-N
XLogP0.48
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R,4R,6R)-2-azabicyclo[4.2.1]nonan-4-amine?
The IUPAC name of (1R,4R,6R)-2-azabicyclo[4.2.1]nonan-4-amine (CID 155155417) is (1R,4R,6R)-2-azabicyclo[4.2.1]nonan-4-amine.
What is the SMILES notation for (1R,4R,6R)-2-azabicyclo[4.2.1]nonan-4-amine?
The canonical SMILES for (1R,4R,6R)-2-azabicyclo[4.2.1]nonan-4-amine is N[C@H]1CN[C@@H]2CC[C@H](C1)C2.
What is the InChIKey of (1R,4R,6R)-2-azabicyclo[4.2.1]nonan-4-amine?
The InChIKey is OAXLCXGAYOENHB-BWZBUEFSSA-N. The full InChI is InChI=1S/C8H16N2/c9-7-3-6-1-2-8(4-6)10-5-7/h6-8,10H,1-5,9H2/t6-,7-,8-/m1/s1.
What are the key properties of (1R,4R,6R)-2-azabicyclo[4.2.1]nonan-4-amine?
(1R,4R,6R)-2-azabicyclo[4.2.1]nonan-4-amine has a molecular weight of 140.23 g/mol, XLogP of 0.48, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,4R,6R)-2-azabicyclo[4.2.1]nonan-4-amine is sourced from PubChem (CID 155155417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).