9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol

C9H18N2O — CID 115013780

IUPAC9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol
SMILESCN1CC2CC(O)CC(C1)C2N
InChIInChI=1S/C9H18N2O/c1-11-4-6-2-8(12)3-7(5-11)9(6)10/h6-9,12H,2-5,10H2,1H3
InChIKeyJYBFOJSFQGLKOV-UHFFFAOYSA-N
MW170.26 g/mol
LogP-0.35
Rot. Bonds

About 9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol

9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol (PubChem CID 115013780) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol.

Molecular Properties

Compound Name9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol
PubChem CID115013780
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol
SMILESCN1CC2CC(O)CC(C1)C2N
InChIInChI=1S/C9H18N2O/c1-11-4-6-2-8(12)3-7(5-11)9(6)10/h6-9,12H,2-5,10H2,1H3
InChIKeyJYBFOJSFQGLKOV-UHFFFAOYSA-N
XLogP-0.35
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol with MolForge

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Related Compounds

(3aR,6aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol
CID 147950414
(1S,5S)-3-methyl-3-azabicyclo[3.3.1]nonan-9-amine
CID 98086940
ethane;methane;3-methyl-3-azabicyclo[3.2.1]octan-8-amine
CID 177136991
9-amino-3-oxabicyclo[3.3.1]nonan-7-ol
CID 115012270
(6R)-3-methyl-3-azabicyclo[3.2.0]heptan-6-ol
CID 122450712
3,7-dimethyl-3-azabicyclo[3.3.1]nonan-9-ol
CID 115013655
3-(3-aminocyclobutyl)cyclobutan-1-ol
CID 147350454
3-methyl-3-azabicyclo[3.1.0]hexane;N-methylmethanamine
CID 142484502
(1R,4R,6S,7R)-2-methyl-2-azabicyclo[2.2.1]heptane-6,7-diamine
CID 129230384
methyl 6-amino-3-azabicyclo[3.1.1]heptane-3-carboxylate
CID 130815114
(3aR,6aS)-2-[2-(2-ethylphenoxy)ethyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol
CID 138809274
N,2-dimethyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-amine
CID 59398149

Frequently Asked Questions

What is the IUPAC name of 9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol?
The IUPAC name of 9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol (CID 115013780) is 9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol.
What is the SMILES notation for 9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol?
The canonical SMILES for 9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol is CN1CC2CC(O)CC(C1)C2N.
What is the InChIKey of 9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol?
The InChIKey is JYBFOJSFQGLKOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-11-4-6-2-8(12)3-7(5-11)9(6)10/h6-9,12H,2-5,10H2,1H3.
What are the key properties of 9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol?
9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol has a molecular weight of 170.26 g/mol, XLogP of -0.35, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-amino-3-methyl-3-azabicyclo[3.3.1]nonan-7-ol is sourced from PubChem (CID 115013780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).