6,8-diazabicyclo[3.2.2]nonan-6-amine

C7H15N3 — CID 137488680

IUPAC6,8-diazabicyclo[3.2.2]nonan-6-amine
SMILESNN1CC2CCCC1CN2
InChIInChI=1S/C7H15N3/c8-10-5-6-2-1-3-7(10)4-9-6/h6-7,9H,1-5,8H2
InChIKeyIDQLAMCTCQJBJT-UHFFFAOYSA-N
MW141.22 g/mol
LogP-0.31
Rot. Bonds

About 6,8-diazabicyclo[3.2.2]nonan-6-amine

6,8-diazabicyclo[3.2.2]nonan-6-amine (PubChem CID 137488680) has the molecular formula C7H15N3 and a molecular weight of 141.22 g/mol. Its IUPAC name is 6,8-diazabicyclo[3.2.2]nonan-6-amine.

Molecular Properties

Compound Name6,8-diazabicyclo[3.2.2]nonan-6-amine
PubChem CID137488680
Molecular FormulaC7H15N3
Molecular Weight141.22 g/mol
Exact Mass141.13
IUPAC Name6,8-diazabicyclo[3.2.2]nonan-6-amine
SMILESNN1CC2CCCC1CN2
InChIInChI=1S/C7H15N3/c8-10-5-6-2-1-3-7(10)4-9-6/h6-7,9H,1-5,8H2
InChIKeyIDQLAMCTCQJBJT-UHFFFAOYSA-N
XLogP-0.31
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.22
LogP ≤ 5-0.31
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

2-methyl-2,5-diazabicyclo[2.2.2]octane;hydrochloride
CID 131676431
3-methyl-3,9-diazabicyclo[3.3.2]decane
CID 84650080
(1R,4R)-2-cyclohexyl-2,5-diazabicyclo[2.2.1]heptane
CID 89202936
2-hydroxy-2,5-diazabicyclo[2.2.2]octane
CID 170269413
3,9-diazabicyclo[3.3.1]nonan-9-amine
CID 155383691
(1S,4S)-2-methyl-2,5-diazabicyclo[2.2.1]heptane;hydrobromide
CID 66776606
cyclopentyl(2,5-diazabicyclo[2.2.2]octan-2-yl)methanone
CID 175882089
2-methylsulfinyl-2,5-diazabicyclo[2.2.2]octane
CID 130664241
2-methyl-2-azabicyclo[2.2.1]heptane;2-methyl-2,5-diazabicyclo[2.2.1]heptane
CID 144525170
2-ethyl-2,6-diazabicyclo[3.2.2]nonane
CID 146602390
2-(cyclopent-3-en-1-ylmethyl)-2,5-diazabicyclo[2.2.2]octane
CID 164660543
2-(2,5-diazabicyclo[2.2.2]octan-2-yl)acetic acid;dihydrochloride
CID 155970873

Frequently Asked Questions

What is the IUPAC name of 6,8-diazabicyclo[3.2.2]nonan-6-amine?
The IUPAC name of 6,8-diazabicyclo[3.2.2]nonan-6-amine (CID 137488680) is 6,8-diazabicyclo[3.2.2]nonan-6-amine.
What is the SMILES notation for 6,8-diazabicyclo[3.2.2]nonan-6-amine?
The canonical SMILES for 6,8-diazabicyclo[3.2.2]nonan-6-amine is NN1CC2CCCC1CN2.
What is the InChIKey of 6,8-diazabicyclo[3.2.2]nonan-6-amine?
The InChIKey is IDQLAMCTCQJBJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3/c8-10-5-6-2-1-3-7(10)4-9-6/h6-7,9H,1-5,8H2.
What are the key properties of 6,8-diazabicyclo[3.2.2]nonan-6-amine?
6,8-diazabicyclo[3.2.2]nonan-6-amine has a molecular weight of 141.22 g/mol, XLogP of -0.31, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-diazabicyclo[3.2.2]nonan-6-amine is sourced from PubChem (CID 137488680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).