ethyl 2-[2-methoxyethyl-[(5-phenyl-1,3-oxazol-2-yl)methyl]amino]acetate

C17H22N2O4 — CID 60528147

IUPACethyl 2-[2-methoxyethyl-[(5-phenyl-1,3-oxazol-2-yl)methyl]amino]acetate
SMILESCCOC(=O)CN(CCOC)Cc1ncc(-c2ccccc2)o1
InChIInChI=1S/C17H22N2O4/c1-3-22-17(20)13-19(9-10-21-2)12-16-18-11-15(23-16)14-7-5-4-6-8-14/h4-8,11H,3,9-10,12-13H2,1-2H3
InChIKeyOONGIJFFPZIPFS-UHFFFAOYSA-N
MW318.37 g/mol
LogP2.35
Rot. Bonds9

About ethyl 2-[2-methoxyethyl-[(5-phenyl-1,3-oxazol-2-yl)methyl]amino]acetate

ethyl 2-[2-methoxyethyl-[(5-phenyl-1,3-oxazol-2-yl)methyl]amino]acetate (PubChem CID 60528147) has the molecular formula C17H22N2O4 and a molecular weight of 318.37 g/mol. Its IUPAC name is ethyl 2-[2-methoxyethyl-[(5-phenyl-1,3-oxazol-2-yl)methyl]amino]acetate.

Molecular Properties

Compound Nameethyl 2-[2-methoxyethyl-[(5-phenyl-1,3-oxazol-2-yl)methyl]amino]acetate
PubChem CID60528147
Molecular FormulaC17H22N2O4
Molecular Weight318.37 g/mol
Exact Mass318.16
IUPAC Nameethyl 2-[2-methoxyethyl-[(5-phenyl-1,3-oxazol-2-yl)methyl]amino]acetate
SMILESCCOC(=O)CN(CCOC)Cc1ncc(-c2ccccc2)o1
InChIInChI=1S/C17H22N2O4/c1-3-22-17(20)13-19(9-10-21-2)12-16-18-11-15(23-16)14-7-5-4-6-8-14/h4-8,11H,3,9-10,12-13H2,1-2H3
InChIKeyOONGIJFFPZIPFS-UHFFFAOYSA-N
XLogP2.35
TPSA64.80 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.37
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-[2-methoxyethyl-[(5-phenyl-1,3-oxazol-2-yl)methyl]amino]acetate?
The IUPAC name of ethyl 2-[2-methoxyethyl-[(5-phenyl-1,3-oxazol-2-yl)methyl]amino]acetate (CID 60528147) is ethyl 2-[2-methoxyethyl-[(5-phenyl-1,3-oxazol-2-yl)methyl]amino]acetate.
What is the SMILES notation for ethyl 2-[2-methoxyethyl-[(5-phenyl-1,3-oxazol-2-yl)methyl]amino]acetate?
The canonical SMILES for ethyl 2-[2-methoxyethyl-[(5-phenyl-1,3-oxazol-2-yl)methyl]amino]acetate is CCOC(=O)CN(CCOC)Cc1ncc(-c2ccccc2)o1.
What is the InChIKey of ethyl 2-[2-methoxyethyl-[(5-phenyl-1,3-oxazol-2-yl)methyl]amino]acetate?
The InChIKey is OONGIJFFPZIPFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O4/c1-3-22-17(20)13-19(9-10-21-2)12-16-18-11-15(23-16)14-7-5-4-6-8-14/h4-8,11H,3,9-10,12-13H2,1-2H3.
What are the key properties of ethyl 2-[2-methoxyethyl-[(5-phenyl-1,3-oxazol-2-yl)methyl]amino]acetate?
ethyl 2-[2-methoxyethyl-[(5-phenyl-1,3-oxazol-2-yl)methyl]amino]acetate has a molecular weight of 318.37 g/mol, XLogP of 2.35, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[2-methoxyethyl-[(5-phenyl-1,3-oxazol-2-yl)methyl]amino]acetate is sourced from PubChem (CID 60528147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).