3-[2-[2-(1-aminoethyl)morpholin-4-yl]acetyl]-1,3-oxazolidin-2-one

C11H19N3O4 — CID 113285046

IUPAC3-[2-[2-(1-aminoethyl)morpholin-4-yl]acetyl]-1,3-oxazolidin-2-one
SMILESCC(N)C1CN(CC(=O)N2CCOC2=O)CCO1
InChIInChI=1S/C11H19N3O4/c1-8(12)9-6-13(2-4-17-9)7-10(15)14-3-5-18-11(14)16/h8-9H,2-7,12H2,1H3
InChIKeyAUJCVLQYSZTGBO-UHFFFAOYSA-N
MW257.29 g/mol
LogP-0.99
Rot. Bonds3

About 3-[2-[2-(1-aminoethyl)morpholin-4-yl]acetyl]-1,3-oxazolidin-2-one

3-[2-[2-(1-aminoethyl)morpholin-4-yl]acetyl]-1,3-oxazolidin-2-one (PubChem CID 113285046) has the molecular formula C11H19N3O4 and a molecular weight of 257.29 g/mol. Its IUPAC name is 3-[2-[2-(1-aminoethyl)morpholin-4-yl]acetyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[2-[2-(1-aminoethyl)morpholin-4-yl]acetyl]-1,3-oxazolidin-2-one
PubChem CID113285046
Molecular FormulaC11H19N3O4
Molecular Weight257.29 g/mol
Exact Mass257.14
IUPAC Name3-[2-[2-(1-aminoethyl)morpholin-4-yl]acetyl]-1,3-oxazolidin-2-one
SMILESCC(N)C1CN(CC(=O)N2CCOC2=O)CCO1
InChIInChI=1S/C11H19N3O4/c1-8(12)9-6-13(2-4-17-9)7-10(15)14-3-5-18-11(14)16/h8-9H,2-7,12H2,1H3
InChIKeyAUJCVLQYSZTGBO-UHFFFAOYSA-N
XLogP-0.99
TPSA85.10 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 5-0.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-[2-(3-amino-4-methylpyrrolidin-1-yl)acetyl]-1,3-oxazolidin-2-one
CID 103577185
3-[2-[(3S)-3-hydroxypiperidin-1-yl]acetyl]-1,3-oxazolidin-2-one
CID 107225668
2-[2-(1-aminoethyl)morpholin-4-yl]-1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethanone
CID 81497057
1-[2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]piperidine-3,4-dicarboxylic acid
CID 115918754
2-[4-[2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]piperazin-1-yl]propanoic acid
CID 62312465
2-[2-(1-aminoethyl)morpholin-4-yl]-N-(4-bromophenyl)acetamide
CID 81490207
2-[2-(1-aminoethyl)morpholin-4-yl]-N-(1,1-dioxothiolan-3-yl)acetamide
CID 81490518
1-(4-propylmorpholin-2-yl)ethanamine
CID 79658084
3-(3-methylbutanoyl)-1,3-oxazolidin-2-one
CID 10352137
2-[2-(1-aminoethyl)morpholin-4-yl]-N-(2-chlorophenyl)acetamide
CID 81490299
2-[2-(1-aminoethyl)morpholin-4-yl]-N-(2,5-dimethylphenyl)acetamide
CID 81497407
2-[2-(1-aminoethyl)morpholin-4-yl]-N-(2,4-dimethylphenyl)acetamide
CID 81497195

Frequently Asked Questions

What is the IUPAC name of 3-[2-[2-(1-aminoethyl)morpholin-4-yl]acetyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[2-[2-(1-aminoethyl)morpholin-4-yl]acetyl]-1,3-oxazolidin-2-one (CID 113285046) is 3-[2-[2-(1-aminoethyl)morpholin-4-yl]acetyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[2-[2-(1-aminoethyl)morpholin-4-yl]acetyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[2-[2-(1-aminoethyl)morpholin-4-yl]acetyl]-1,3-oxazolidin-2-one is CC(N)C1CN(CC(=O)N2CCOC2=O)CCO1.
What is the InChIKey of 3-[2-[2-(1-aminoethyl)morpholin-4-yl]acetyl]-1,3-oxazolidin-2-one?
The InChIKey is AUJCVLQYSZTGBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O4/c1-8(12)9-6-13(2-4-17-9)7-10(15)14-3-5-18-11(14)16/h8-9H,2-7,12H2,1H3.
What are the key properties of 3-[2-[2-(1-aminoethyl)morpholin-4-yl]acetyl]-1,3-oxazolidin-2-one?
3-[2-[2-(1-aminoethyl)morpholin-4-yl]acetyl]-1,3-oxazolidin-2-one has a molecular weight of 257.29 g/mol, XLogP of -0.99, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[2-(1-aminoethyl)morpholin-4-yl]acetyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 113285046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).