ethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate

C10H19NO3 — CID 19755076

IUPACethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate
SMILESCCOC(=O)N1C(C)(C)COC1(C)C
InChIInChI=1S/C10H19NO3/c1-6-13-8(12)11-9(2,3)7-14-10(11,4)5/h6-7H2,1-5H3
InChIKeyWOCMGZWJJQPFGY-UHFFFAOYSA-N
MW201.27 g/mol
LogP1.99
Rot. Bonds1

About ethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate

ethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate (PubChem CID 19755076) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is ethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate.

Molecular Properties

Compound Nameethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate
PubChem CID19755076
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Nameethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate
SMILESCCOC(=O)N1C(C)(C)COC1(C)C
InChIInChI=1S/C10H19NO3/c1-6-13-8(12)11-9(2,3)7-14-10(11,4)5/h6-7H2,1-5H3
InChIKeyWOCMGZWJJQPFGY-UHFFFAOYSA-N
XLogP1.99
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate?
The IUPAC name of ethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate (CID 19755076) is ethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate.
What is the SMILES notation for ethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate?
The canonical SMILES for ethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate is CCOC(=O)N1C(C)(C)COC1(C)C.
What is the InChIKey of ethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate?
The InChIKey is WOCMGZWJJQPFGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-6-13-8(12)11-9(2,3)7-14-10(11,4)5/h6-7H2,1-5H3.
What are the key properties of ethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate?
ethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate has a molecular weight of 201.27 g/mol, XLogP of 1.99, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2,2,4,4-tetramethyl-1,3-oxazolidine-3-carboxylate is sourced from PubChem (CID 19755076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).