5-(4-methylphenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-1,2-oxazolidine

C24H23NO — CID 15359846

IUPAC5-(4-methylphenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-1,2-oxazolidine
SMILESCc1ccc(C2CC(/C=C/c3ccccc3)N(c3ccccc3)O2)cc1
InChIInChI=1S/C24H23NO/c1-19-12-15-21(16-13-19)24-18-23(17-14-20-8-4-2-5-9-20)25(26-24)22-10-6-3-7-11-22/h2-17,23-24H,18H2,1H3/b17-14+
InChIKeyWZNWWSQBVJSTOF-SAPNQHFASA-N
MW341.45 g/mol
LogP5.96
Rot. Bonds4

About 5-(4-methylphenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-1,2-oxazolidine

5-(4-methylphenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-1,2-oxazolidine (PubChem CID 15359846) has the molecular formula C24H23NO and a molecular weight of 341.45 g/mol. Its IUPAC name is 5-(4-methylphenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-1,2-oxazolidine.

Molecular Properties

Compound Name5-(4-methylphenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-1,2-oxazolidine
PubChem CID15359846
Molecular FormulaC24H23NO
Molecular Weight341.45 g/mol
Exact Mass341.18
IUPAC Name5-(4-methylphenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-1,2-oxazolidine
SMILESCc1ccc(C2CC(/C=C/c3ccccc3)N(c3ccccc3)O2)cc1
InChIInChI=1S/C24H23NO/c1-19-12-15-21(16-13-19)24-18-23(17-14-20-8-4-2-5-9-20)25(26-24)22-10-6-3-7-11-22/h2-17,23-24H,18H2,1H3/b17-14+
InChIKeyWZNWWSQBVJSTOF-SAPNQHFASA-N
XLogP5.96
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.45
LogP ≤ 55.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(4-methylphenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-1,2-oxazolidine?
The IUPAC name of 5-(4-methylphenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-1,2-oxazolidine (CID 15359846) is 5-(4-methylphenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-1,2-oxazolidine.
What is the SMILES notation for 5-(4-methylphenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-1,2-oxazolidine?
The canonical SMILES for 5-(4-methylphenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-1,2-oxazolidine is Cc1ccc(C2CC(/C=C/c3ccccc3)N(c3ccccc3)O2)cc1.
What is the InChIKey of 5-(4-methylphenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-1,2-oxazolidine?
The InChIKey is WZNWWSQBVJSTOF-SAPNQHFASA-N. The full InChI is InChI=1S/C24H23NO/c1-19-12-15-21(16-13-19)24-18-23(17-14-20-8-4-2-5-9-20)25(26-24)22-10-6-3-7-11-22/h2-17,23-24H,18H2,1H3/b17-14+.
What are the key properties of 5-(4-methylphenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-1,2-oxazolidine?
5-(4-methylphenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-1,2-oxazolidine has a molecular weight of 341.45 g/mol, XLogP of 5.96, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylphenyl)-2-phenyl-3-[(E)-2-phenylethenyl]-1,2-oxazolidine is sourced from PubChem (CID 15359846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).