(1R,6S,7S)-1,7-dimethyl-3,8-diazabicyclo[3.2.1]octan-6-ol

C8H16N2O — CID 175638369

IUPAC(1R,6S,7S)-1,7-dimethyl-3,8-diazabicyclo[3.2.1]octan-6-ol
SMILESC[C@@H]1[C@H](O)C2CNC[C@]1(C)N2
InChIInChI=1S/C8H16N2O/c1-5-7(11)6-3-9-4-8(5,2)10-6/h5-7,9-11H,3-4H2,1-2H3/t5-,6?,7+,8+/m1/s1
InChIKeyFVLHIRHLLVXWLT-BJLRKGDGSA-N
MW156.23 g/mol
LogP-0.68
Rot. Bonds

About (1R,6S,7S)-1,7-dimethyl-3,8-diazabicyclo[3.2.1]octan-6-ol

(1R,6S,7S)-1,7-dimethyl-3,8-diazabicyclo[3.2.1]octan-6-ol (PubChem CID 175638369) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is (1R,6S,7S)-1,7-dimethyl-3,8-diazabicyclo[3.2.1]octan-6-ol.

Molecular Properties

Compound Name(1R,6S,7S)-1,7-dimethyl-3,8-diazabicyclo[3.2.1]octan-6-ol
PubChem CID175638369
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name(1R,6S,7S)-1,7-dimethyl-3,8-diazabicyclo[3.2.1]octan-6-ol
SMILESC[C@@H]1[C@H](O)C2CNC[C@]1(C)N2
InChIInChI=1S/C8H16N2O/c1-5-7(11)6-3-9-4-8(5,2)10-6/h5-7,9-11H,3-4H2,1-2H3/t5-,6?,7+,8+/m1/s1
InChIKeyFVLHIRHLLVXWLT-BJLRKGDGSA-N
XLogP-0.68
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 5-0.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (1R,6S,7S)-1,7-dimethyl-3,8-diazabicyclo[3.2.1]octan-6-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3S,4S)-5,5-dimethylpiperidine-3,4-diol
CID 11550031
3,4,5-trimethylpiperidin-4-ol;hydrochloride
CID 175817344
(6S)-2,2-diethyl-6-methylpiperazine
CID 82416009
5-methyl-3-azabicyclo[3.2.0]heptan-6-ol
CID 139417373
(2R)-2,6,6-trimethyl-1,4-oxazepane
CID 177088964
azetidin-3-ol;ethane;3-methylazetidin-3-ol
CID 145216921
3,5-dimethylpiperidin-4-ol;ethane
CID 176666809
(1S,5R,6R)-1,6-dimethyl-3-azabicyclo[3.2.0]heptane
CID 143715084
(3S,4S)-3,4-dimethyl-3-propan-2-ylpyrrolidine
CID 118444596
(3R,4S)-3-ethyl-3,4-dimethylpyrrolidine
CID 130186897
2,2,6-trimethylmorpholine;hydrochloride
CID 172641070
(4R)-3,4-dimethyl-3-propan-2-ylpyrrolidine
CID 135170137

Frequently Asked Questions

What is the IUPAC name of (1R,6S,7S)-1,7-dimethyl-3,8-diazabicyclo[3.2.1]octan-6-ol?
The IUPAC name of (1R,6S,7S)-1,7-dimethyl-3,8-diazabicyclo[3.2.1]octan-6-ol (CID 175638369) is (1R,6S,7S)-1,7-dimethyl-3,8-diazabicyclo[3.2.1]octan-6-ol.
What is the SMILES notation for (1R,6S,7S)-1,7-dimethyl-3,8-diazabicyclo[3.2.1]octan-6-ol?
The canonical SMILES for (1R,6S,7S)-1,7-dimethyl-3,8-diazabicyclo[3.2.1]octan-6-ol is C[C@@H]1[C@H](O)C2CNC[C@]1(C)N2.
What is the InChIKey of (1R,6S,7S)-1,7-dimethyl-3,8-diazabicyclo[3.2.1]octan-6-ol?
The InChIKey is FVLHIRHLLVXWLT-BJLRKGDGSA-N. The full InChI is InChI=1S/C8H16N2O/c1-5-7(11)6-3-9-4-8(5,2)10-6/h5-7,9-11H,3-4H2,1-2H3/t5-,6?,7+,8+/m1/s1.
What are the key properties of (1R,6S,7S)-1,7-dimethyl-3,8-diazabicyclo[3.2.1]octan-6-ol?
(1R,6S,7S)-1,7-dimethyl-3,8-diazabicyclo[3.2.1]octan-6-ol has a molecular weight of 156.23 g/mol, XLogP of -0.68, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,6S,7S)-1,7-dimethyl-3,8-diazabicyclo[3.2.1]octan-6-ol is sourced from PubChem (CID 175638369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).