(1R,2R,5R)-2-methyl-8-azabicyclo[3.2.1]octane

C8H15N — CID 164990465

IUPAC(1R,2R,5R)-2-methyl-8-azabicyclo[3.2.1]octane
SMILESC[C@@H]1CC[C@@H]2CC[C@H]1N2
InChIInChI=1S/C8H15N/c1-6-2-3-7-4-5-8(6)9-7/h6-9H,2-5H2,1H3/t6-,7-,8-/m1/s1
InChIKeyXZNKZEUXGOEXAM-BWZBUEFSSA-N
MW125.22 g/mol
LogP1.54
Rot. Bonds

About (1R,2R,5R)-2-methyl-8-azabicyclo[3.2.1]octane

(1R,2R,5R)-2-methyl-8-azabicyclo[3.2.1]octane (PubChem CID 164990465) has the molecular formula C8H15N and a molecular weight of 125.22 g/mol. Its IUPAC name is (1R,2R,5R)-2-methyl-8-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name(1R,2R,5R)-2-methyl-8-azabicyclo[3.2.1]octane
PubChem CID164990465
Molecular FormulaC8H15N
Molecular Weight125.22 g/mol
Exact Mass125.12
IUPAC Name(1R,2R,5R)-2-methyl-8-azabicyclo[3.2.1]octane
SMILESC[C@@H]1CC[C@@H]2CC[C@H]1N2
InChIInChI=1S/C8H15N/c1-6-2-3-7-4-5-8(6)9-7/h6-9H,2-5H2,1H3/t6-,7-,8-/m1/s1
InChIKeyXZNKZEUXGOEXAM-BWZBUEFSSA-N
XLogP1.54
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.22
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R,5S)-2-fluoro-8-azabicyclo[3.2.1]octane
CID 175691789
(1S,2R,5S)-8-azabicyclo[3.2.1]octane-2-carboxylic acid;hydrochloride
CID 133268759
2-methyl-8-azabicyclo[3.2.1]octan-3-one
CID 88987015
(6R)-3,6-dimethyl-8-azabicyclo[3.2.1]octane
CID 129313885
1-[(1R,2R,6R)-9-azabicyclo[4.2.1]nonan-2-yl]ethanone
CID 93498894
2-tert-butyl-7-azabicyclo[2.2.1]heptane
CID 21352057
7-azabicyclo[2.2.1]heptan-2-ol
CID 18009146
7-azabicyclo[2.2.1]heptan-2-amine
CID 18534976
(1R,2R,4S)-7-azabicyclo[2.2.1]heptan-2-ol
CID 10261070
33,34,35,36,37,38,39,40-octazanonacyclo[28.2.1.12,5.16,9.110,13.114,17.118,21.122,25.126,29]tetracontane
CID 90995297
2-methyl-5-[(2R,5S)-5-[5-[(2R,5S)-5-[5-[(2R,5S)-5-[5-[(2R)-5-methylpyrrolidin-2-yl]pyrrolidin-2-yl]pyrrolidin-2-yl]pyrrolidin-2-yl]pyrrolidin-2-yl]pyrrolidin-2-yl]pyrrolidin-2-yl]pyrrolidine
CID 58594538
(1R,2R,4S)-7-azabicyclo[2.2.1]heptan-2-ol;hydrochloride
CID 118998031

Frequently Asked Questions

What is the IUPAC name of (1R,2R,5R)-2-methyl-8-azabicyclo[3.2.1]octane?
The IUPAC name of (1R,2R,5R)-2-methyl-8-azabicyclo[3.2.1]octane (CID 164990465) is (1R,2R,5R)-2-methyl-8-azabicyclo[3.2.1]octane.
What is the SMILES notation for (1R,2R,5R)-2-methyl-8-azabicyclo[3.2.1]octane?
The canonical SMILES for (1R,2R,5R)-2-methyl-8-azabicyclo[3.2.1]octane is C[C@@H]1CC[C@@H]2CC[C@H]1N2.
What is the InChIKey of (1R,2R,5R)-2-methyl-8-azabicyclo[3.2.1]octane?
The InChIKey is XZNKZEUXGOEXAM-BWZBUEFSSA-N. The full InChI is InChI=1S/C8H15N/c1-6-2-3-7-4-5-8(6)9-7/h6-9H,2-5H2,1H3/t6-,7-,8-/m1/s1.
What are the key properties of (1R,2R,5R)-2-methyl-8-azabicyclo[3.2.1]octane?
(1R,2R,5R)-2-methyl-8-azabicyclo[3.2.1]octane has a molecular weight of 125.22 g/mol, XLogP of 1.54, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R,5R)-2-methyl-8-azabicyclo[3.2.1]octane is sourced from PubChem (CID 164990465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).