(2R,3R)-1-ethyl-2,3-diphenylazetidine

C17H19N — CID 100941432

IUPAC(2R,3R)-1-ethyl-2,3-diphenylazetidine
SMILESCCN1C[C@@H](c2ccccc2)[C@@H]1c1ccccc1
InChIInChI=1S/C17H19N/c1-2-18-13-16(14-9-5-3-6-10-14)17(18)15-11-7-4-8-12-15/h3-12,16-17H,2,13H2,1H3/t16-,17-/m0/s1
InChIKeyKOCGMAWSLSYXFJ-IRXDYDNUSA-N
MW237.35 g/mol
LogP3.85
Rot. Bonds3

About (2R,3R)-1-ethyl-2,3-diphenylazetidine

(2R,3R)-1-ethyl-2,3-diphenylazetidine (PubChem CID 100941432) has the molecular formula C17H19N and a molecular weight of 237.35 g/mol. Its IUPAC name is (2R,3R)-1-ethyl-2,3-diphenylazetidine.

Molecular Properties

Compound Name(2R,3R)-1-ethyl-2,3-diphenylazetidine
PubChem CID100941432
Molecular FormulaC17H19N
Molecular Weight237.35 g/mol
Exact Mass237.15
IUPAC Name(2R,3R)-1-ethyl-2,3-diphenylazetidine
SMILESCCN1C[C@@H](c2ccccc2)[C@@H]1c1ccccc1
InChIInChI=1S/C17H19N/c1-2-18-13-16(14-9-5-3-6-10-14)17(18)15-11-7-4-8-12-15/h3-12,16-17H,2,13H2,1H3/t16-,17-/m0/s1
InChIKeyKOCGMAWSLSYXFJ-IRXDYDNUSA-N
XLogP3.85
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (2R,3R)-1-ethyl-2,3-diphenylazetidine 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 (2R,3R)-1-ethyl-2,3-diphenylazetidine?
The IUPAC name of (2R,3R)-1-ethyl-2,3-diphenylazetidine (CID 100941432) is (2R,3R)-1-ethyl-2,3-diphenylazetidine.
What is the SMILES notation for (2R,3R)-1-ethyl-2,3-diphenylazetidine?
The canonical SMILES for (2R,3R)-1-ethyl-2,3-diphenylazetidine is CCN1C[C@@H](c2ccccc2)[C@@H]1c1ccccc1.
What is the InChIKey of (2R,3R)-1-ethyl-2,3-diphenylazetidine?
The InChIKey is KOCGMAWSLSYXFJ-IRXDYDNUSA-N. The full InChI is InChI=1S/C17H19N/c1-2-18-13-16(14-9-5-3-6-10-14)17(18)15-11-7-4-8-12-15/h3-12,16-17H,2,13H2,1H3/t16-,17-/m0/s1.
What are the key properties of (2R,3R)-1-ethyl-2,3-diphenylazetidine?
(2R,3R)-1-ethyl-2,3-diphenylazetidine has a molecular weight of 237.35 g/mol, XLogP of 3.85, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-1-ethyl-2,3-diphenylazetidine is sourced from PubChem (CID 100941432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).