6-methyl-2,6-diazabicyclo[3.2.1]octane

C7H14N2 — CID 146675323

IUPAC6-methyl-2,6-diazabicyclo[3.2.1]octane
SMILESCN1CC2CC1CCN2
InChIInChI=1S/C7H14N2/c1-9-5-6-4-7(9)2-3-8-6/h6-8H,2-5H2,1H3
InChIKeyNRMGNCUOELQPGW-UHFFFAOYSA-N
MW126.20 g/mol
LogP0.05
Rot. Bonds

About 6-methyl-2,6-diazabicyclo[3.2.1]octane

6-methyl-2,6-diazabicyclo[3.2.1]octane (PubChem CID 146675323) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is 6-methyl-2,6-diazabicyclo[3.2.1]octane.

Molecular Properties

Compound Name6-methyl-2,6-diazabicyclo[3.2.1]octane
PubChem CID146675323
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Name6-methyl-2,6-diazabicyclo[3.2.1]octane
SMILESCN1CC2CC1CCN2
InChIInChI=1S/C7H14N2/c1-9-5-6-4-7(9)2-3-8-6/h6-8H,2-5H2,1H3
InChIKeyNRMGNCUOELQPGW-UHFFFAOYSA-N
XLogP0.05
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2,6-diazabicyclo[3.2.1]octane?
The IUPAC name of 6-methyl-2,6-diazabicyclo[3.2.1]octane (CID 146675323) is 6-methyl-2,6-diazabicyclo[3.2.1]octane.
What is the SMILES notation for 6-methyl-2,6-diazabicyclo[3.2.1]octane?
The canonical SMILES for 6-methyl-2,6-diazabicyclo[3.2.1]octane is CN1CC2CC1CCN2.
What is the InChIKey of 6-methyl-2,6-diazabicyclo[3.2.1]octane?
The InChIKey is NRMGNCUOELQPGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2/c1-9-5-6-4-7(9)2-3-8-6/h6-8H,2-5H2,1H3.
What are the key properties of 6-methyl-2,6-diazabicyclo[3.2.1]octane?
6-methyl-2,6-diazabicyclo[3.2.1]octane has a molecular weight of 126.20 g/mol, XLogP of 0.05, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2,6-diazabicyclo[3.2.1]octane is sourced from PubChem (CID 146675323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).