4-amino-4-azatricyclo[4.2.1.03,7]nonan-2-ol

C8H14N2O — CID 130495046

IUPAC4-amino-4-azatricyclo[4.2.1.03,7]nonan-2-ol
SMILESNN1CC2CC3CC2C1C3O
InChIInChI=1S/C8H14N2O/c9-10-3-5-1-4-2-6(5)7(10)8(4)11/h4-8,11H,1-3,9H2
InChIKeyLFZXTTMNACXMGJ-UHFFFAOYSA-N
MW154.21 g/mol
LogP-0.44
Rot. Bonds

About 4-amino-4-azatricyclo[4.2.1.03,7]nonan-2-ol

4-amino-4-azatricyclo[4.2.1.03,7]nonan-2-ol (PubChem CID 130495046) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 4-amino-4-azatricyclo[4.2.1.03,7]nonan-2-ol.

Molecular Properties

Compound Name4-amino-4-azatricyclo[4.2.1.03,7]nonan-2-ol
PubChem CID130495046
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name4-amino-4-azatricyclo[4.2.1.03,7]nonan-2-ol
SMILESNN1CC2CC3CC2C1C3O
InChIInChI=1S/C8H14N2O/c9-10-3-5-1-4-2-6(5)7(10)8(4)11/h4-8,11H,1-3,9H2
InChIKeyLFZXTTMNACXMGJ-UHFFFAOYSA-N
XLogP-0.44
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Related Compounds

4-methylsulfonyl-4-azatricyclo[4.2.1.03,7]nonan-2-ol
CID 102154722
4-(2-hydroxy-4-azatricyclo[4.2.1.03,7]nonan-4-yl)butan-2-one
CID 130494985
5-(2-hydroxy-4-azatricyclo[4.2.1.03,7]nonan-4-yl)-5-oxopentanoic acid
CID 114247375
N-tert-butyl-2-hydroxy-4-azatricyclo[4.2.1.03,7]nonane-4-carboxamide
CID 114247391
1-cyclopentyl-2-(2-hydroxy-4-azatricyclo[4.2.1.03,7]nonan-4-yl)ethanone
CID 114247506
6-(2-hydroxy-4-azatricyclo[4.2.1.03,7]nonan-4-yl)-6-oxohexanoic acid
CID 114247377
4-(3-amino-4-pyridinyl)-4-azatricyclo[4.2.1.03,7]nonan-2-ol
CID 114247306
2-(aminomethyl)-1-(2-hydroxy-4-azatricyclo[4.2.1.03,7]nonan-4-yl)-2-methylbutan-1-one
CID 114247386
(2-hydroxy-4-azatricyclo[4.2.1.03,7]nonan-4-yl)-morpholin-4-ylmethanone
CID 114247390
1-(2-hydroxy-4-azatricyclo[4.2.1.03,7]nonan-4-yl)hexan-1-one
CID 114247546
4-[(6-amino-2-pyridinyl)methyl]-4-azatricyclo[4.2.1.03,7]nonan-2-ol
CID 114247708
4-[(2-amino-1,3-thiazol-5-yl)methyl]-4-azatricyclo[4.2.1.03,7]nonan-2-ol
CID 120903823

Frequently Asked Questions

What is the IUPAC name of 4-amino-4-azatricyclo[4.2.1.03,7]nonan-2-ol?
The IUPAC name of 4-amino-4-azatricyclo[4.2.1.03,7]nonan-2-ol (CID 130495046) is 4-amino-4-azatricyclo[4.2.1.03,7]nonan-2-ol.
What is the SMILES notation for 4-amino-4-azatricyclo[4.2.1.03,7]nonan-2-ol?
The canonical SMILES for 4-amino-4-azatricyclo[4.2.1.03,7]nonan-2-ol is NN1CC2CC3CC2C1C3O.
What is the InChIKey of 4-amino-4-azatricyclo[4.2.1.03,7]nonan-2-ol?
The InChIKey is LFZXTTMNACXMGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c9-10-3-5-1-4-2-6(5)7(10)8(4)11/h4-8,11H,1-3,9H2.
What are the key properties of 4-amino-4-azatricyclo[4.2.1.03,7]nonan-2-ol?
4-amino-4-azatricyclo[4.2.1.03,7]nonan-2-ol has a molecular weight of 154.21 g/mol, XLogP of -0.44, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-4-azatricyclo[4.2.1.03,7]nonan-2-ol is sourced from PubChem (CID 130495046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).