N,3-dimethyl-3-azabicyclo[3.3.1]nonan-9-amine

C10H20N2 — CID 59828343

IUPACN,3-dimethyl-3-azabicyclo[3.3.1]nonan-9-amine
SMILESCNC1C2CCCC1CN(C)C2
InChIInChI=1S/C10H20N2/c1-11-10-8-4-3-5-9(10)7-12(2)6-8/h8-11H,3-7H2,1-2H3
InChIKeyMCBLHOQTOYYMRX-UHFFFAOYSA-N
MW168.28 g/mol
LogP0.94
Rot. Bonds1

About N,3-dimethyl-3-azabicyclo[3.3.1]nonan-9-amine

N,3-dimethyl-3-azabicyclo[3.3.1]nonan-9-amine (PubChem CID 59828343) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is N,3-dimethyl-3-azabicyclo[3.3.1]nonan-9-amine.

Molecular Properties

Compound NameN,3-dimethyl-3-azabicyclo[3.3.1]nonan-9-amine
PubChem CID59828343
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC NameN,3-dimethyl-3-azabicyclo[3.3.1]nonan-9-amine
SMILESCNC1C2CCCC1CN(C)C2
InChIInChI=1S/C10H20N2/c1-11-10-8-4-3-5-9(10)7-12(2)6-8/h8-11H,3-7H2,1-2H3
InChIKeyMCBLHOQTOYYMRX-UHFFFAOYSA-N
XLogP0.94
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-3-azabicyclo[3.3.1]nonan-9-amine?
The IUPAC name of N,3-dimethyl-3-azabicyclo[3.3.1]nonan-9-amine (CID 59828343) is N,3-dimethyl-3-azabicyclo[3.3.1]nonan-9-amine.
What is the SMILES notation for N,3-dimethyl-3-azabicyclo[3.3.1]nonan-9-amine?
The canonical SMILES for N,3-dimethyl-3-azabicyclo[3.3.1]nonan-9-amine is CNC1C2CCCC1CN(C)C2.
What is the InChIKey of N,3-dimethyl-3-azabicyclo[3.3.1]nonan-9-amine?
The InChIKey is MCBLHOQTOYYMRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-11-10-8-4-3-5-9(10)7-12(2)6-8/h8-11H,3-7H2,1-2H3.
What are the key properties of N,3-dimethyl-3-azabicyclo[3.3.1]nonan-9-amine?
N,3-dimethyl-3-azabicyclo[3.3.1]nonan-9-amine has a molecular weight of 168.28 g/mol, XLogP of 0.94, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-3-azabicyclo[3.3.1]nonan-9-amine is sourced from PubChem (CID 59828343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).