N-(1-azabicyclo[3.2.1]octan-4-yl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine

C15H27N3 — CID 105365541

IUPACN-(1-azabicyclo[3.2.1]octan-4-yl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCN(C1CC2CCC(C1)N2)C1CCN2CCC1C2
InChIInChI=1S/C15H27N3/c1-17(14-8-12-2-3-13(9-14)16-12)15-5-7-18-6-4-11(15)10-18/h11-16H,2-10H2,1H3
InChIKeyQJARJSYXSMVWJS-UHFFFAOYSA-N
MW249.40 g/mol
LogP1.30
Rot. Bonds2

About N-(1-azabicyclo[3.2.1]octan-4-yl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine

N-(1-azabicyclo[3.2.1]octan-4-yl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 105365541) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is N-(1-azabicyclo[3.2.1]octan-4-yl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound NameN-(1-azabicyclo[3.2.1]octan-4-yl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID105365541
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC NameN-(1-azabicyclo[3.2.1]octan-4-yl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCN(C1CC2CCC(C1)N2)C1CCN2CCC1C2
InChIInChI=1S/C15H27N3/c1-17(14-8-12-2-3-13(9-14)16-12)15-5-7-18-6-4-11(15)10-18/h11-16H,2-10H2,1H3
InChIKeyQJARJSYXSMVWJS-UHFFFAOYSA-N
XLogP1.30
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-azabicyclo[3.2.1]octan-4-yl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of N-(1-azabicyclo[3.2.1]octan-4-yl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine (CID 105365541) is N-(1-azabicyclo[3.2.1]octan-4-yl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for N-(1-azabicyclo[3.2.1]octan-4-yl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for N-(1-azabicyclo[3.2.1]octan-4-yl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine is CN(C1CC2CCC(C1)N2)C1CCN2CCC1C2.
What is the InChIKey of N-(1-azabicyclo[3.2.1]octan-4-yl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is QJARJSYXSMVWJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-17(14-8-12-2-3-13(9-14)16-12)15-5-7-18-6-4-11(15)10-18/h11-16H,2-10H2,1H3.
What are the key properties of N-(1-azabicyclo[3.2.1]octan-4-yl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine?
N-(1-azabicyclo[3.2.1]octan-4-yl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 249.40 g/mol, XLogP of 1.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-azabicyclo[3.2.1]octan-4-yl)-N-methyl-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 105365541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).