(1S,5S,6R,7R)-3-azatricyclo[3.3.1.03,7]nonan-6-amine

C8H14N2 — CID 131849177

IUPAC(1S,5S,6R,7R)-3-azatricyclo[3.3.1.03,7]nonan-6-amine
SMILESN[C@@H]1[C@H]2C[C@H]3C[C@H]1N(C3)C2
InChIInChI=1S/C8H14N2/c9-8-6-1-5-2-7(8)10(3-5)4-6/h5-8H,1-4,9H2/t5-,6-,7+,8+/m0/s1
InChIKeyFQYLZVMOMRUQLQ-RULNZFCNSA-N
MW138.21 g/mol
LogP0.04
Rot. Bonds

About (1S,5S,6R,7R)-3-azatricyclo[3.3.1.03,7]nonan-6-amine

(1S,5S,6R,7R)-3-azatricyclo[3.3.1.03,7]nonan-6-amine (PubChem CID 131849177) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is (1S,5S,6R,7R)-3-azatricyclo[3.3.1.03,7]nonan-6-amine.

Molecular Properties

Compound Name(1S,5S,6R,7R)-3-azatricyclo[3.3.1.03,7]nonan-6-amine
PubChem CID131849177
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name(1S,5S,6R,7R)-3-azatricyclo[3.3.1.03,7]nonan-6-amine
SMILESN[C@@H]1[C@H]2C[C@H]3C[C@H]1N(C3)C2
InChIInChI=1S/C8H14N2/c9-8-6-1-5-2-7(8)10(3-5)4-6/h5-8H,1-4,9H2/t5-,6-,7+,8+/m0/s1
InChIKeyFQYLZVMOMRUQLQ-RULNZFCNSA-N
XLogP0.04
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1S,5S,6R,7R)-3-azatricyclo[3.3.1.03,7]nonan-6-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1R,5S,6S,7R)-3-azatricyclo[3.3.1.03,7]nonane-6-carbonitrile
CID 131849088
(1R,5S,6S,7S)-3-azatricyclo[3.3.1.03,7]nonane-6-carbonitrile
CID 45088204
3-cyclopropyl-3-azabicyclo[3.1.1]heptan-6-amine
CID 47003630
3-(4-methylthiolan-3-yl)-3-azabicyclo[3.1.1]heptan-6-amine
CID 131198222
2-(2,4-dimethylpentan-3-yl)-2-azabicyclo[2.1.1]hexan-5-amine
CID 130820042
4-(2-bicyclo[2.2.1]heptanyl)-2,6-dimethylmorpholine
CID 2846659
2-(5-amino-2-azabicyclo[2.1.1]hexan-2-yl)-N-methylpropanamide
CID 130874740
2-(6-chloropyridazin-3-yl)-2-azabicyclo[2.1.1]hexan-5-amine
CID 131059274
(1S,6R)-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-6-amine
CID 155648652
2-propan-2-yl-2-azabicyclo[2.2.1]heptan-6-amine
CID 129231151
2-(1,5-dimethylpyrrolidin-3-yl)-2-azabicyclo[2.1.1]hexan-5-amine
CID 130961406
adamantane-2,4-diamine
CID 12813520

Frequently Asked Questions

What is the IUPAC name of (1S,5S,6R,7R)-3-azatricyclo[3.3.1.03,7]nonan-6-amine?
The IUPAC name of (1S,5S,6R,7R)-3-azatricyclo[3.3.1.03,7]nonan-6-amine (CID 131849177) is (1S,5S,6R,7R)-3-azatricyclo[3.3.1.03,7]nonan-6-amine.
What is the SMILES notation for (1S,5S,6R,7R)-3-azatricyclo[3.3.1.03,7]nonan-6-amine?
The canonical SMILES for (1S,5S,6R,7R)-3-azatricyclo[3.3.1.03,7]nonan-6-amine is N[C@@H]1[C@H]2C[C@H]3C[C@H]1N(C3)C2.
What is the InChIKey of (1S,5S,6R,7R)-3-azatricyclo[3.3.1.03,7]nonan-6-amine?
The InChIKey is FQYLZVMOMRUQLQ-RULNZFCNSA-N. The full InChI is InChI=1S/C8H14N2/c9-8-6-1-5-2-7(8)10(3-5)4-6/h5-8H,1-4,9H2/t5-,6-,7+,8+/m0/s1.
What are the key properties of (1S,5S,6R,7R)-3-azatricyclo[3.3.1.03,7]nonan-6-amine?
(1S,5S,6R,7R)-3-azatricyclo[3.3.1.03,7]nonan-6-amine has a molecular weight of 138.21 g/mol, XLogP of 0.04, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,5S,6R,7R)-3-azatricyclo[3.3.1.03,7]nonan-6-amine is sourced from PubChem (CID 131849177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).