3,5-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol

C8H15NO — CID 122450683

IUPAC3,5-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol
SMILESCN1CC2CC(O)C2(C)C1
InChIInChI=1S/C8H15NO/c1-8-5-9(2)4-6(8)3-7(8)10/h6-7,10H,3-5H2,1-2H3
InChIKeyMHSYJXBTWHHTDB-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.32
Rot. Bonds

About 3,5-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol

3,5-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol (PubChem CID 122450683) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 3,5-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol.

Molecular Properties

Compound Name3,5-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol
PubChem CID122450683
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name3,5-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol
SMILESCN1CC2CC(O)C2(C)C1
InChIInChI=1S/C8H15NO/c1-8-5-9(2)4-6(8)3-7(8)10/h6-7,10H,3-5H2,1-2H3
InChIKeyMHSYJXBTWHHTDB-UHFFFAOYSA-N
XLogP0.32
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol?
The IUPAC name of 3,5-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol (CID 122450683) is 3,5-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol.
What is the SMILES notation for 3,5-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol?
The canonical SMILES for 3,5-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol is CN1CC2CC(O)C2(C)C1.
What is the InChIKey of 3,5-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol?
The InChIKey is MHSYJXBTWHHTDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-8-5-9(2)4-6(8)3-7(8)10/h6-7,10H,3-5H2,1-2H3.
What are the key properties of 3,5-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol?
3,5-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol has a molecular weight of 141.21 g/mol, XLogP of 0.32, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol is sourced from PubChem (CID 122450683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).