(2R,4R)-3-benzyl-4-phenyl-2-(2-phenylethyl)-1,3-oxazolidine

C24H25NO — CID 11067883

IUPAC(2R,4R)-3-benzyl-4-phenyl-2-(2-phenylethyl)-1,3-oxazolidine
SMILESc1ccc(CC[C@H]2OC[C@@H](c3ccccc3)N2Cc2ccccc2)cc1
InChIInChI=1S/C24H25NO/c1-4-10-20(11-5-1)16-17-24-25(18-21-12-6-2-7-13-21)23(19-26-24)22-14-8-3-9-15-22/h1-15,23-24H,16-19H2/t23-,24+/m0/s1
InChIKeyNSGCICFLJCDWGC-BJKOFHAPSA-N
MW343.47 g/mol
LogP5.22
Rot. Bonds6

About (2R,4R)-3-benzyl-4-phenyl-2-(2-phenylethyl)-1,3-oxazolidine

(2R,4R)-3-benzyl-4-phenyl-2-(2-phenylethyl)-1,3-oxazolidine (PubChem CID 11067883) has the molecular formula C24H25NO and a molecular weight of 343.47 g/mol. Its IUPAC name is (2R,4R)-3-benzyl-4-phenyl-2-(2-phenylethyl)-1,3-oxazolidine.

Molecular Properties

Compound Name(2R,4R)-3-benzyl-4-phenyl-2-(2-phenylethyl)-1,3-oxazolidine
PubChem CID11067883
Molecular FormulaC24H25NO
Molecular Weight343.47 g/mol
Exact Mass343.19
IUPAC Name(2R,4R)-3-benzyl-4-phenyl-2-(2-phenylethyl)-1,3-oxazolidine
SMILESc1ccc(CC[C@H]2OC[C@@H](c3ccccc3)N2Cc2ccccc2)cc1
InChIInChI=1S/C24H25NO/c1-4-10-20(11-5-1)16-17-24-25(18-21-12-6-2-7-13-21)23(19-26-24)22-14-8-3-9-15-22/h1-15,23-24H,16-19H2/t23-,24+/m0/s1
InChIKeyNSGCICFLJCDWGC-BJKOFHAPSA-N
XLogP5.22
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.47
LogP ≤ 55.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R,4R)-3-benzyl-4-phenyl-2-(2-phenylethyl)-1,3-oxazolidine?
The IUPAC name of (2R,4R)-3-benzyl-4-phenyl-2-(2-phenylethyl)-1,3-oxazolidine (CID 11067883) is (2R,4R)-3-benzyl-4-phenyl-2-(2-phenylethyl)-1,3-oxazolidine.
What is the SMILES notation for (2R,4R)-3-benzyl-4-phenyl-2-(2-phenylethyl)-1,3-oxazolidine?
The canonical SMILES for (2R,4R)-3-benzyl-4-phenyl-2-(2-phenylethyl)-1,3-oxazolidine is c1ccc(CC[C@H]2OC[C@@H](c3ccccc3)N2Cc2ccccc2)cc1.
What is the InChIKey of (2R,4R)-3-benzyl-4-phenyl-2-(2-phenylethyl)-1,3-oxazolidine?
The InChIKey is NSGCICFLJCDWGC-BJKOFHAPSA-N. The full InChI is InChI=1S/C24H25NO/c1-4-10-20(11-5-1)16-17-24-25(18-21-12-6-2-7-13-21)23(19-26-24)22-14-8-3-9-15-22/h1-15,23-24H,16-19H2/t23-,24+/m0/s1.
What are the key properties of (2R,4R)-3-benzyl-4-phenyl-2-(2-phenylethyl)-1,3-oxazolidine?
(2R,4R)-3-benzyl-4-phenyl-2-(2-phenylethyl)-1,3-oxazolidine has a molecular weight of 343.47 g/mol, XLogP of 5.22, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4R)-3-benzyl-4-phenyl-2-(2-phenylethyl)-1,3-oxazolidine is sourced from PubChem (CID 11067883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).