2-(2-propan-2-yl-1,3-oxazolidin-3-yl)ethyl acetate

C10H19NO3 — CID 142421262

IUPAC2-(2-propan-2-yl-1,3-oxazolidin-3-yl)ethyl acetate
SMILESCC(=O)OCCN1CCOC1C(C)C
InChIInChI=1S/C10H19NO3/c1-8(2)10-11(5-7-14-10)4-6-13-9(3)12/h8,10H,4-7H2,1-3H3
InChIKeyQYXZYVYHFCYDJA-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.86
Rot. Bonds4

About 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)ethyl acetate

2-(2-propan-2-yl-1,3-oxazolidin-3-yl)ethyl acetate (PubChem CID 142421262) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)ethyl acetate.

Molecular Properties

Compound Name2-(2-propan-2-yl-1,3-oxazolidin-3-yl)ethyl acetate
PubChem CID142421262
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Name2-(2-propan-2-yl-1,3-oxazolidin-3-yl)ethyl acetate
SMILESCC(=O)OCCN1CCOC1C(C)C
InChIInChI=1S/C10H19NO3/c1-8(2)10-11(5-7-14-10)4-6-13-9(3)12/h8,10H,4-7H2,1-3H3
InChIKeyQYXZYVYHFCYDJA-UHFFFAOYSA-N
XLogP0.86
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Glycine, N,N-diisobutyl-, ethyl ester
CID 17538
N-Acetoxyethylpyrrolidine
CID 98815
Carbonic acid, methyl 2-[2-(1-methylethyl)-3-oxazolidinyl]ethyl ester
CID 73555336
1-(2-Ethoxy-2-oxoethyl)-1-methylpyrrolidin-1-ium iodide
CID 89170
Acetylpyrrolidinecholine
CID 6452992
2-Acetyloxyethyl-dimethyl-propylazanium
CID 35633
Ethyl 2-(1-methylpyrrolidin-1-ium-1-yl)acetate
CID 89171
Ethyl 3-(4,4-dimethyl-1,3-oxazolidin-3-yl)-2,2-dimethylpropanoate
CID 294819
3-Ethyl-2-(propan-2-yl)-1,3-oxazolidine
CID 258838
N-(2-ethanoyloxyethyl)-1,3-oxazolidine
CID 129761601
alpha-Methyl-2-(1-methylethyl)oxazolidine-3-ethyl acetate
CID 89407
Methyl 4-acetyloxy-2-propan-2-yl-1,3-oxazolidine-3-carboxylate
CID 581830

Frequently Asked Questions

What is the IUPAC name of 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)ethyl acetate?
The IUPAC name of 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)ethyl acetate (CID 142421262) is 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)ethyl acetate.
What is the SMILES notation for 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)ethyl acetate?
The canonical SMILES for 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)ethyl acetate is CC(=O)OCCN1CCOC1C(C)C.
What is the InChIKey of 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)ethyl acetate?
The InChIKey is QYXZYVYHFCYDJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-8(2)10-11(5-7-14-10)4-6-13-9(3)12/h8,10H,4-7H2,1-3H3.
What are the key properties of 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)ethyl acetate?
2-(2-propan-2-yl-1,3-oxazolidin-3-yl)ethyl acetate has a molecular weight of 201.27 g/mol, XLogP of 0.86, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propan-2-yl-1,3-oxazolidin-3-yl)ethyl acetate is sourced from PubChem (CID 142421262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).