(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

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Related Compounds

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CID 53230801
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(2R,3R)-2,3-diphenyl-1-propan-2-ylazetidine
CID 100941434
1-ethyl-3-methyl-4-phenylpyrrolidine
CID 130451678
(1R,5S)-3-ethyl-6-phenyl-3-azabicyclo[3.1.0]hexane
CID 70451157
ethane;1-ethyl-2-phenylpyrrolidine
CID 177062481
1-ethyl-2-phenyl-4-propan-2-ylpiperazine
CID 138492479
1-ethyl-4-methoxy-2-phenylpiperazine
CID 70136749
(2R,3R)-1-benzyl-2-(chloromethyl)-3-phenylazetidine
CID 101250941
1-ethyl-2-phenylazepane
CID 59678181
1-(1-benzyl-3-phenylazetidin-2-yl)ethanone
CID 86209046

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).