3,8-dimethyl-8-azabicyclo[3.2.1]octan-2-amine

C9H18N2 — CID 58019053

IUPAC3,8-dimethyl-8-azabicyclo[3.2.1]octan-2-amine
SMILESCC1CC2CCC(C1N)N2C
InChIInChI=1S/C9H18N2/c1-6-5-7-3-4-8(9(6)10)11(7)2/h6-9H,3-5,10H2,1-2H3
InChIKeyJJJNCWIMYLCPRV-UHFFFAOYSA-N
MW154.26 g/mol
LogP0.82
Rot. Bonds

About 3,8-dimethyl-8-azabicyclo[3.2.1]octan-2-amine

3,8-dimethyl-8-azabicyclo[3.2.1]octan-2-amine (PubChem CID 58019053) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 3,8-dimethyl-8-azabicyclo[3.2.1]octan-2-amine.

Molecular Properties

Compound Name3,8-dimethyl-8-azabicyclo[3.2.1]octan-2-amine
PubChem CID58019053
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name3,8-dimethyl-8-azabicyclo[3.2.1]octan-2-amine
SMILESCC1CC2CCC(C1N)N2C
InChIInChI=1S/C9H18N2/c1-6-5-7-3-4-8(9(6)10)11(7)2/h6-9H,3-5,10H2,1-2H3
InChIKeyJJJNCWIMYLCPRV-UHFFFAOYSA-N
XLogP0.82
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,8-dimethyl-8-azabicyclo[3.2.1]octan-2-amine?
The IUPAC name of 3,8-dimethyl-8-azabicyclo[3.2.1]octan-2-amine (CID 58019053) is 3,8-dimethyl-8-azabicyclo[3.2.1]octan-2-amine.
What is the SMILES notation for 3,8-dimethyl-8-azabicyclo[3.2.1]octan-2-amine?
The canonical SMILES for 3,8-dimethyl-8-azabicyclo[3.2.1]octan-2-amine is CC1CC2CCC(C1N)N2C.
What is the InChIKey of 3,8-dimethyl-8-azabicyclo[3.2.1]octan-2-amine?
The InChIKey is JJJNCWIMYLCPRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-6-5-7-3-4-8(9(6)10)11(7)2/h6-9H,3-5,10H2,1-2H3.
What are the key properties of 3,8-dimethyl-8-azabicyclo[3.2.1]octan-2-amine?
3,8-dimethyl-8-azabicyclo[3.2.1]octan-2-amine has a molecular weight of 154.26 g/mol, XLogP of 0.82, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,8-dimethyl-8-azabicyclo[3.2.1]octan-2-amine is sourced from PubChem (CID 58019053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).