ethyl 2-[cyclopropyl-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]acetate

C14H20N2O4 — CID 61410019

IUPACethyl 2-[cyclopropyl-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]acetate
SMILESCCOC(=O)CN(C(=O)c1c(CC)noc1C)C1CC1
InChIInChI=1S/C14H20N2O4/c1-4-11-13(9(3)20-15-11)14(18)16(10-6-7-10)8-12(17)19-5-2/h10H,4-8H2,1-3H3
InChIKeySHRJSGFKLMVEMY-UHFFFAOYSA-N
MW280.32 g/mol
LogP1.71
Rot. Bonds6

About ethyl 2-[cyclopropyl-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]acetate

ethyl 2-[cyclopropyl-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]acetate (PubChem CID 61410019) has the molecular formula C14H20N2O4 and a molecular weight of 280.32 g/mol. Its IUPAC name is ethyl 2-[cyclopropyl-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]acetate.

Molecular Properties

Compound Nameethyl 2-[cyclopropyl-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]acetate
PubChem CID61410019
Molecular FormulaC14H20N2O4
Molecular Weight280.32 g/mol
Exact Mass280.14
IUPAC Nameethyl 2-[cyclopropyl-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]acetate
SMILESCCOC(=O)CN(C(=O)c1c(CC)noc1C)C1CC1
InChIInChI=1S/C14H20N2O4/c1-4-11-13(9(3)20-15-11)14(18)16(10-6-7-10)8-12(17)19-5-2/h10H,4-8H2,1-3H3
InChIKeySHRJSGFKLMVEMY-UHFFFAOYSA-N
XLogP1.71
TPSA72.64 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze ethyl 2-[cyclopropyl-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)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

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[cyclopropyl-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]acetate?
The IUPAC name of ethyl 2-[cyclopropyl-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]acetate (CID 61410019) is ethyl 2-[cyclopropyl-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]acetate.
What is the SMILES notation for ethyl 2-[cyclopropyl-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]acetate?
The canonical SMILES for ethyl 2-[cyclopropyl-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]acetate is CCOC(=O)CN(C(=O)c1c(CC)noc1C)C1CC1.
What is the InChIKey of ethyl 2-[cyclopropyl-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]acetate?
The InChIKey is SHRJSGFKLMVEMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4/c1-4-11-13(9(3)20-15-11)14(18)16(10-6-7-10)8-12(17)19-5-2/h10H,4-8H2,1-3H3.
What are the key properties of ethyl 2-[cyclopropyl-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]acetate?
ethyl 2-[cyclopropyl-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]acetate has a molecular weight of 280.32 g/mol, XLogP of 1.71, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[cyclopropyl-(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]acetate is sourced from PubChem (CID 61410019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).