4-(ethoxymethylidene)-2-phenyl-1,3-oxazolidine

C12H15NO2 — CID 174059769

IUPAC4-(ethoxymethylidene)-2-phenyl-1,3-oxazolidine
SMILESCCOC=C1COC(c2ccccc2)N1
InChIInChI=1S/C12H15NO2/c1-2-14-8-11-9-15-12(13-11)10-6-4-3-5-7-10/h3-8,12-13H,2,9H2,1H3
InChIKeyOYKULDDEHAEPLV-UHFFFAOYSA-N
MW205.26 g/mol
LogP2.18
Rot. Bonds3

About 4-(ethoxymethylidene)-2-phenyl-1,3-oxazolidine

4-(ethoxymethylidene)-2-phenyl-1,3-oxazolidine (PubChem CID 174059769) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is 4-(ethoxymethylidene)-2-phenyl-1,3-oxazolidine.

Molecular Properties

Compound Name4-(ethoxymethylidene)-2-phenyl-1,3-oxazolidine
PubChem CID174059769
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Name4-(ethoxymethylidene)-2-phenyl-1,3-oxazolidine
SMILESCCOC=C1COC(c2ccccc2)N1
InChIInChI=1S/C12H15NO2/c1-2-14-8-11-9-15-12(13-11)10-6-4-3-5-7-10/h3-8,12-13H,2,9H2,1H3
InChIKeyOYKULDDEHAEPLV-UHFFFAOYSA-N
XLogP2.18
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

5,5-bis(ethoxymethyl)-2-phenyl-1,3-dioxane
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4-(ethoxymethyl)-2-phenyl-2,5-dihydrofuran
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(3S)-3-phenyloxaziridine
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3-phenyloxaziridine
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ethyl (2E)-2-(5-phenyloxolan-2-ylidene)acetate
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2-phenyl-1,3-oxazolidine-4-carbothialdehyde
CID 141379634
CID 53230801
CID 53230801
2-ethyl-5-phenyl-1,4-oxazepane
CID 83218632
3-ethoxy-4-phenyl-4,5-dihydro-1,2,5-oxadiazin-6-one
CID 102088123
cyclobutylbenzene;triethoxysilane
CID 174943415
[4-(4-ethoxycyclohexyl)cyclohexyl]benzene
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CID 142973096

Frequently Asked Questions

What is the IUPAC name of 4-(ethoxymethylidene)-2-phenyl-1,3-oxazolidine?
The IUPAC name of 4-(ethoxymethylidene)-2-phenyl-1,3-oxazolidine (CID 174059769) is 4-(ethoxymethylidene)-2-phenyl-1,3-oxazolidine.
What is the SMILES notation for 4-(ethoxymethylidene)-2-phenyl-1,3-oxazolidine?
The canonical SMILES for 4-(ethoxymethylidene)-2-phenyl-1,3-oxazolidine is CCOC=C1COC(c2ccccc2)N1.
What is the InChIKey of 4-(ethoxymethylidene)-2-phenyl-1,3-oxazolidine?
The InChIKey is OYKULDDEHAEPLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c1-2-14-8-11-9-15-12(13-11)10-6-4-3-5-7-10/h3-8,12-13H,2,9H2,1H3.
What are the key properties of 4-(ethoxymethylidene)-2-phenyl-1,3-oxazolidine?
4-(ethoxymethylidene)-2-phenyl-1,3-oxazolidine has a molecular weight of 205.26 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethoxymethylidene)-2-phenyl-1,3-oxazolidine is sourced from PubChem (CID 174059769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).