ethyl 2-(2-ethyl-1,3-oxazol-5-yl)acetate

C9H13NO3 — CID 58201688

IUPACethyl 2-(2-ethyl-1,3-oxazol-5-yl)acetate
SMILESCCOC(=O)Cc1cnc(CC)o1
InChIInChI=1S/C9H13NO3/c1-3-8-10-6-7(13-8)5-9(11)12-4-2/h6H,3-5H2,1-2H3
InChIKeyZEYNCVZGARUDAT-UHFFFAOYSA-N
MW183.21 g/mol
LogP1.34
Rot. Bonds4

About ethyl 2-(2-ethyl-1,3-oxazol-5-yl)acetate

ethyl 2-(2-ethyl-1,3-oxazol-5-yl)acetate (PubChem CID 58201688) has the molecular formula C9H13NO3 and a molecular weight of 183.21 g/mol. Its IUPAC name is ethyl 2-(2-ethyl-1,3-oxazol-5-yl)acetate.

Molecular Properties

Compound Nameethyl 2-(2-ethyl-1,3-oxazol-5-yl)acetate
PubChem CID58201688
Molecular FormulaC9H13NO3
Molecular Weight183.21 g/mol
Exact Mass183.09
IUPAC Nameethyl 2-(2-ethyl-1,3-oxazol-5-yl)acetate
SMILESCCOC(=O)Cc1cnc(CC)o1
InChIInChI=1S/C9H13NO3/c1-3-8-10-6-7(13-8)5-9(11)12-4-2/h6H,3-5H2,1-2H3
InChIKeyZEYNCVZGARUDAT-UHFFFAOYSA-N
XLogP1.34
TPSA52.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze ethyl 2-(2-ethyl-1,3-oxazol-5-yl)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 2-(5-amino-4-methyl-2-pyridinyl)acetate
CID 133098372
ethyl 2-[(5-ethyl-1,3-oxazol-2-yl)methylamino]butanoate
CID 106371541
ethyl 2-(5-amino-2-bromo-4-pyridinyl)acetate
CID 133098456
1-[2-(2-ethyl-1,3-oxazol-5-yl)ethyl]cyclopropan-1-amine
CID 105438866
methyl 2-ethyl-1,3-oxazole-5-carboxylate
CID 118990037
ethyl 2-(1,3,4-oxadiazol-2-yl)acetate
CID 55212087
ethyl 2-(4,5-dimethyl-1,3-oxazol-2-yl)acetate
CID 164562691
ethyl 2-[4,5-bis(4-aminophenyl)-1,3-oxazol-2-yl]acetate
CID 58533133
ethyl 2-(5-chloro-1-benzofuran-2-yl)acetate
CID 82645490
ethyl 2-[5-(nitromethyl)furan-2-yl]acetate
CID 101021120
3-(5-ethyl-1,3-oxazol-2-yl)propanoic acid
CID 84653363
2-(5-propyl-1,3-oxazol-2-yl)acetic acid
CID 115013535

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(2-ethyl-1,3-oxazol-5-yl)acetate?
The IUPAC name of ethyl 2-(2-ethyl-1,3-oxazol-5-yl)acetate (CID 58201688) is ethyl 2-(2-ethyl-1,3-oxazol-5-yl)acetate.
What is the SMILES notation for ethyl 2-(2-ethyl-1,3-oxazol-5-yl)acetate?
The canonical SMILES for ethyl 2-(2-ethyl-1,3-oxazol-5-yl)acetate is CCOC(=O)Cc1cnc(CC)o1.
What is the InChIKey of ethyl 2-(2-ethyl-1,3-oxazol-5-yl)acetate?
The InChIKey is ZEYNCVZGARUDAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO3/c1-3-8-10-6-7(13-8)5-9(11)12-4-2/h6H,3-5H2,1-2H3.
What are the key properties of ethyl 2-(2-ethyl-1,3-oxazol-5-yl)acetate?
ethyl 2-(2-ethyl-1,3-oxazol-5-yl)acetate has a molecular weight of 183.21 g/mol, XLogP of 1.34, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(2-ethyl-1,3-oxazol-5-yl)acetate is sourced from PubChem (CID 58201688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).