1,3-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol

C8H15NO — CID 122450687

IUPAC1,3-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol
SMILESCN1CC2C(O)CC2(C)C1
InChIInChI=1S/C8H15NO/c1-8-3-7(10)6(8)4-9(2)5-8/h6-7,10H,3-5H2,1-2H3
InChIKeySIHRILBMZIGJQN-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.32
Rot. Bonds

About 1,3-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol

1,3-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol (PubChem CID 122450687) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 1,3-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol.

Molecular Properties

Compound Name1,3-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol
PubChem CID122450687
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name1,3-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol
SMILESCN1CC2C(O)CC2(C)C1
InChIInChI=1S/C8H15NO/c1-8-3-7(10)6(8)4-9(2)5-8/h6-7,10H,3-5H2,1-2H3
InChIKeySIHRILBMZIGJQN-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

Analyze 1,3-dimethyl-3-azabicyclo[3.2.0]heptan-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

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol?
The IUPAC name of 1,3-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol (CID 122450687) is 1,3-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol.
What is the SMILES notation for 1,3-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol?
The canonical SMILES for 1,3-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol is CN1CC2C(O)CC2(C)C1.
What is the InChIKey of 1,3-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol?
The InChIKey is SIHRILBMZIGJQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-8-3-7(10)6(8)4-9(2)5-8/h6-7,10H,3-5H2,1-2H3.
What are the key properties of 1,3-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol?
1,3-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 1,3-dimethyl-3-azabicyclo[3.2.0]heptan-6-ol is sourced from PubChem (CID 122450687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).