2-azabicyclo[2.2.1]heptan-3-yl(diphenyl)methanol

C19H21NO — CID 73192690

IUPAC2-azabicyclo[2.2.1]heptan-3-yl(diphenyl)methanol
SMILESOC(c1ccccc1)(c1ccccc1)C1NC2CCC1C2
InChIInChI=1S/C19H21NO/c21-19(15-7-3-1-4-8-15,16-9-5-2-6-10-16)18-14-11-12-17(13-14)20-18/h1-10,14,17-18,20-21H,11-13H2
InChIKeyXOYJAFGAWSBPTI-UHFFFAOYSA-N
MW279.38 g/mol
LogP3.06
Rot. Bonds3

About 2-azabicyclo[2.2.1]heptan-3-yl(diphenyl)methanol

2-azabicyclo[2.2.1]heptan-3-yl(diphenyl)methanol (PubChem CID 73192690) has the molecular formula C19H21NO and a molecular weight of 279.38 g/mol. Its IUPAC name is 2-azabicyclo[2.2.1]heptan-3-yl(diphenyl)methanol.

Molecular Properties

Compound Name2-azabicyclo[2.2.1]heptan-3-yl(diphenyl)methanol
PubChem CID73192690
Molecular FormulaC19H21NO
Molecular Weight279.38 g/mol
Exact Mass279.16
IUPAC Name2-azabicyclo[2.2.1]heptan-3-yl(diphenyl)methanol
SMILESOC(c1ccccc1)(c1ccccc1)C1NC2CCC1C2
InChIInChI=1S/C19H21NO/c21-19(15-7-3-1-4-8-15,16-9-5-2-6-10-16)18-14-11-12-17(13-14)20-18/h1-10,14,17-18,20-21H,11-13H2
InChIKeyXOYJAFGAWSBPTI-UHFFFAOYSA-N
XLogP3.06
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-azabicyclo[2.2.1]heptan-3-yl(diphenyl)methanol 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 2-azabicyclo[2.2.1]heptan-3-yl(diphenyl)methanol?
The IUPAC name of 2-azabicyclo[2.2.1]heptan-3-yl(diphenyl)methanol (CID 73192690) is 2-azabicyclo[2.2.1]heptan-3-yl(diphenyl)methanol.
What is the SMILES notation for 2-azabicyclo[2.2.1]heptan-3-yl(diphenyl)methanol?
The canonical SMILES for 2-azabicyclo[2.2.1]heptan-3-yl(diphenyl)methanol is OC(c1ccccc1)(c1ccccc1)C1NC2CCC1C2.
What is the InChIKey of 2-azabicyclo[2.2.1]heptan-3-yl(diphenyl)methanol?
The InChIKey is XOYJAFGAWSBPTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO/c21-19(15-7-3-1-4-8-15,16-9-5-2-6-10-16)18-14-11-12-17(13-14)20-18/h1-10,14,17-18,20-21H,11-13H2.
What are the key properties of 2-azabicyclo[2.2.1]heptan-3-yl(diphenyl)methanol?
2-azabicyclo[2.2.1]heptan-3-yl(diphenyl)methanol has a molecular weight of 279.38 g/mol, XLogP of 3.06, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azabicyclo[2.2.1]heptan-3-yl(diphenyl)methanol is sourced from PubChem (CID 73192690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).