2,3,4-trimethyl-5-phenyl-1,3-oxazolidine

C12H17NO — CID 5322112

IUPAC2,3,4-trimethyl-5-phenyl-1,3-oxazolidine
SMILESCC1OC(c2ccccc2)C(C)N1C
InChIInChI=1S/C12H17NO/c1-9-12(14-10(2)13(9)3)11-7-5-4-6-8-11/h4-10,12H,1-3H3
InChIKeyHHPJDYZRNRHFBT-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.42
Rot. Bonds1

About 2,3,4-trimethyl-5-phenyl-1,3-oxazolidine

2,3,4-trimethyl-5-phenyl-1,3-oxazolidine (PubChem CID 5322112) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 2,3,4-trimethyl-5-phenyl-1,3-oxazolidine.

Molecular Properties

Compound Name2,3,4-trimethyl-5-phenyl-1,3-oxazolidine
PubChem CID5322112
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name2,3,4-trimethyl-5-phenyl-1,3-oxazolidine
SMILESCC1OC(c2ccccc2)C(C)N1C
InChIInChI=1S/C12H17NO/c1-9-12(14-10(2)13(9)3)11-7-5-4-6-8-11/h4-10,12H,1-3H3
InChIKeyHHPJDYZRNRHFBT-UHFFFAOYSA-N
XLogP2.42
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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3-Methyl-4-nitroso-2-phenylmorpholine
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CID 612175
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Frequently Asked Questions

What is the IUPAC name of 2,3,4-trimethyl-5-phenyl-1,3-oxazolidine?
The IUPAC name of 2,3,4-trimethyl-5-phenyl-1,3-oxazolidine (CID 5322112) is 2,3,4-trimethyl-5-phenyl-1,3-oxazolidine.
What is the SMILES notation for 2,3,4-trimethyl-5-phenyl-1,3-oxazolidine?
The canonical SMILES for 2,3,4-trimethyl-5-phenyl-1,3-oxazolidine is CC1OC(c2ccccc2)C(C)N1C.
What is the InChIKey of 2,3,4-trimethyl-5-phenyl-1,3-oxazolidine?
The InChIKey is HHPJDYZRNRHFBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-9-12(14-10(2)13(9)3)11-7-5-4-6-8-11/h4-10,12H,1-3H3.
What are the key properties of 2,3,4-trimethyl-5-phenyl-1,3-oxazolidine?
2,3,4-trimethyl-5-phenyl-1,3-oxazolidine has a molecular weight of 191.27 g/mol, XLogP of 2.42, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4-trimethyl-5-phenyl-1,3-oxazolidine is sourced from PubChem (CID 5322112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).