8-methyl-2-phenyl-8-azabicyclo[3.2.1]octan-2-ol

C14H19NO — CID 58565898

IUPAC8-methyl-2-phenyl-8-azabicyclo[3.2.1]octan-2-ol
SMILESCN1C2CCC1C(O)(c1ccccc1)CC2
InChIInChI=1S/C14H19NO/c1-15-12-7-8-13(15)14(16,10-9-12)11-5-3-2-4-6-11/h2-6,12-13,16H,7-10H2,1H3
InChIKeyCADMYSJXWHPELS-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.13
Rot. Bonds1

About 8-methyl-2-phenyl-8-azabicyclo[3.2.1]octan-2-ol

8-methyl-2-phenyl-8-azabicyclo[3.2.1]octan-2-ol (PubChem CID 58565898) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 8-methyl-2-phenyl-8-azabicyclo[3.2.1]octan-2-ol.

Molecular Properties

Compound Name8-methyl-2-phenyl-8-azabicyclo[3.2.1]octan-2-ol
PubChem CID58565898
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name8-methyl-2-phenyl-8-azabicyclo[3.2.1]octan-2-ol
SMILESCN1C2CCC1C(O)(c1ccccc1)CC2
InChIInChI=1S/C14H19NO/c1-15-12-7-8-13(15)14(16,10-9-12)11-5-3-2-4-6-11/h2-6,12-13,16H,7-10H2,1H3
InChIKeyCADMYSJXWHPELS-UHFFFAOYSA-N
XLogP2.13
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-2-phenyl-8-azabicyclo[3.2.1]octan-2-ol?
The IUPAC name of 8-methyl-2-phenyl-8-azabicyclo[3.2.1]octan-2-ol (CID 58565898) is 8-methyl-2-phenyl-8-azabicyclo[3.2.1]octan-2-ol.
What is the SMILES notation for 8-methyl-2-phenyl-8-azabicyclo[3.2.1]octan-2-ol?
The canonical SMILES for 8-methyl-2-phenyl-8-azabicyclo[3.2.1]octan-2-ol is CN1C2CCC1C(O)(c1ccccc1)CC2.
What is the InChIKey of 8-methyl-2-phenyl-8-azabicyclo[3.2.1]octan-2-ol?
The InChIKey is CADMYSJXWHPELS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-15-12-7-8-13(15)14(16,10-9-12)11-5-3-2-4-6-11/h2-6,12-13,16H,7-10H2,1H3.
What are the key properties of 8-methyl-2-phenyl-8-azabicyclo[3.2.1]octan-2-ol?
8-methyl-2-phenyl-8-azabicyclo[3.2.1]octan-2-ol has a molecular weight of 217.31 g/mol, XLogP of 2.13, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-2-phenyl-8-azabicyclo[3.2.1]octan-2-ol is sourced from PubChem (CID 58565898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).