ethyl 2-[(2-oxooxolan-3-yl)amino]acetate

C8H13NO4 — CID 43825792

IUPACethyl 2-[(2-oxooxolan-3-yl)amino]acetate
SMILESCCOC(=O)CNC1CCOC1=O
InChIInChI=1S/C8H13NO4/c1-2-12-7(10)5-9-6-3-4-13-8(6)11/h6,9H,2-5H2,1H3
InChIKeyIXOYILQKERJXBF-UHFFFAOYSA-N
MW187.19 g/mol
LogP-0.55
Rot. Bonds4

About ethyl 2-[(2-oxooxolan-3-yl)amino]acetate

ethyl 2-[(2-oxooxolan-3-yl)amino]acetate (PubChem CID 43825792) has the molecular formula C8H13NO4 and a molecular weight of 187.19 g/mol. Its IUPAC name is ethyl 2-[(2-oxooxolan-3-yl)amino]acetate.

Molecular Properties

Compound Nameethyl 2-[(2-oxooxolan-3-yl)amino]acetate
PubChem CID43825792
Molecular FormulaC8H13NO4
Molecular Weight187.19 g/mol
Exact Mass187.08
IUPAC Nameethyl 2-[(2-oxooxolan-3-yl)amino]acetate
SMILESCCOC(=O)CNC1CCOC1=O
InChIInChI=1S/C8H13NO4/c1-2-12-7(10)5-9-6-3-4-13-8(6)11/h6,9H,2-5H2,1H3
InChIKeyIXOYILQKERJXBF-UHFFFAOYSA-N
XLogP-0.55
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.19
LogP ≤ 5-0.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze ethyl 2-[(2-oxooxolan-3-yl)amino]acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl (E)-4-oxo-4-[[(3R)-2-oxooxolan-3-yl]amino]but-2-enoate
CID 59127515
N-(3-methoxyphenyl)-2-[(2-oxooxolan-3-yl)amino]acetamide
CID 43825760
ethyl 2-[[(1S,2R)-2-methylcyclohexyl]amino]acetate
CID 28582368
1-ethyl-3-[(3S)-2-oxooxolan-3-yl]urea
CID 127013922
butyl 2-(3,4-dihydro-2H-chromen-4-ylamino)acetate
CID 62365383
3-(oxan-4-ylmethylamino)oxolan-2-one
CID 130685081
methyl 4-[[(2-oxooxolan-3-yl)amino]methyl]benzoate
CID 43823979
N-(2-oxooxolan-3-yl)pentanamide
CID 11513883
methane;3-oxo-N-(2-oxooxolan-3-yl)pentanamide
CID 159463313
3-methyl-N-(2-oxooxolan-3-yl)pentanamide
CID 59157424
N-[(3R)-2-oxooxolan-3-yl]tetradecanamide
CID 98125839
(E)-N-[(3R)-2-oxooxolan-3-yl]hex-3-enamide
CID 59127522

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[(2-oxooxolan-3-yl)amino]acetate?
The IUPAC name of ethyl 2-[(2-oxooxolan-3-yl)amino]acetate (CID 43825792) is ethyl 2-[(2-oxooxolan-3-yl)amino]acetate.
What is the SMILES notation for ethyl 2-[(2-oxooxolan-3-yl)amino]acetate?
The canonical SMILES for ethyl 2-[(2-oxooxolan-3-yl)amino]acetate is CCOC(=O)CNC1CCOC1=O.
What is the InChIKey of ethyl 2-[(2-oxooxolan-3-yl)amino]acetate?
The InChIKey is IXOYILQKERJXBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO4/c1-2-12-7(10)5-9-6-3-4-13-8(6)11/h6,9H,2-5H2,1H3.
What are the key properties of ethyl 2-[(2-oxooxolan-3-yl)amino]acetate?
ethyl 2-[(2-oxooxolan-3-yl)amino]acetate has a molecular weight of 187.19 g/mol, XLogP of -0.55, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[(2-oxooxolan-3-yl)amino]acetate is sourced from PubChem (CID 43825792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).