3,7-dimethyl-3,6-diazatricyclo[3.2.1.02,7]octane

C8H14N2 — CID 123781299

IUPAC3,7-dimethyl-3,6-diazatricyclo[3.2.1.02,7]octane
SMILESCN1CC2CC3C1C3(C)N2
InChIInChI=1S/C8H14N2/c1-8-6-3-5(9-8)4-10(2)7(6)8/h5-7,9H,3-4H2,1-2H3
InChIKeyVMHONENJVOXTPL-UHFFFAOYSA-N
MW138.21 g/mol
LogP0.05
Rot. Bonds

About 3,7-dimethyl-3,6-diazatricyclo[3.2.1.02,7]octane

3,7-dimethyl-3,6-diazatricyclo[3.2.1.02,7]octane (PubChem CID 123781299) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 3,7-dimethyl-3,6-diazatricyclo[3.2.1.02,7]octane.

Molecular Properties

Compound Name3,7-dimethyl-3,6-diazatricyclo[3.2.1.02,7]octane
PubChem CID123781299
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name3,7-dimethyl-3,6-diazatricyclo[3.2.1.02,7]octane
SMILESCN1CC2CC3C1C3(C)N2
InChIInChI=1S/C8H14N2/c1-8-6-3-5(9-8)4-10(2)7(6)8/h5-7,9H,3-4H2,1-2H3
InChIKeyVMHONENJVOXTPL-UHFFFAOYSA-N
XLogP0.05
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,5,7,7-tetramethyl-2,5-diazabicyclo[2.2.1]heptane
CID 122534447
(1S,4S)-2-methyl-2,5-diazabicyclo[2.2.1]heptane;hydrobromide
CID 66776606
1,3,4,4,5-pentamethylpiperidine
CID 18740724
(3aR,6aR)-5-methyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
CID 34180510
ethane;6-methyl-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine
CID 144987626
1-tert-butyl-9-azabicyclo[3.3.1]nonane
CID 173037930
1,2,2,5-tetramethylpiperazine
CID 64846101
(5R)-7-fluoro-3-methyl-3,9-diazabicyclo[3.3.1]nonane
CID 174083626
(3aR,6aR)-5-methyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;dihydrochloride
CID 135393186
ethane;3-methyl-3,8-diazabicyclo[3.2.1]octane
CID 156708920
1,2,2,6,6-pentamethylpiperidine
CID 6603
1,2,2,7,7-pentamethylazepane
CID 22946774

Frequently Asked Questions

What is the IUPAC name of 3,7-dimethyl-3,6-diazatricyclo[3.2.1.02,7]octane?
The IUPAC name of 3,7-dimethyl-3,6-diazatricyclo[3.2.1.02,7]octane (CID 123781299) is 3,7-dimethyl-3,6-diazatricyclo[3.2.1.02,7]octane.
What is the SMILES notation for 3,7-dimethyl-3,6-diazatricyclo[3.2.1.02,7]octane?
The canonical SMILES for 3,7-dimethyl-3,6-diazatricyclo[3.2.1.02,7]octane is CN1CC2CC3C1C3(C)N2.
What is the InChIKey of 3,7-dimethyl-3,6-diazatricyclo[3.2.1.02,7]octane?
The InChIKey is VMHONENJVOXTPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-8-6-3-5(9-8)4-10(2)7(6)8/h5-7,9H,3-4H2,1-2H3.
What are the key properties of 3,7-dimethyl-3,6-diazatricyclo[3.2.1.02,7]octane?
3,7-dimethyl-3,6-diazatricyclo[3.2.1.02,7]octane has a molecular weight of 138.21 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 3,7-dimethyl-3,6-diazatricyclo[3.2.1.02,7]octane is sourced from PubChem (CID 123781299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).