N-ethyl-N-methyl-2-(phenoxymethyl)-1,3-oxazole-4-carboxamide

C14H16N2O3 — CID 25382765

IUPACN-ethyl-N-methyl-2-(phenoxymethyl)-1,3-oxazole-4-carboxamide
SMILESCCN(C)C(=O)c1coc(COc2ccccc2)n1
InChIInChI=1S/C14H16N2O3/c1-3-16(2)14(17)12-9-19-13(15-12)10-18-11-7-5-4-6-8-11/h4-9H,3,10H2,1-2H3
InChIKeyPRJBOMYEUFYKMH-UHFFFAOYSA-N
MW260.29 g/mol
LogP2.35
Rot. Bonds5

About N-ethyl-N-methyl-2-(phenoxymethyl)-1,3-oxazole-4-carboxamide

N-ethyl-N-methyl-2-(phenoxymethyl)-1,3-oxazole-4-carboxamide (PubChem CID 25382765) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-(phenoxymethyl)-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-(phenoxymethyl)-1,3-oxazole-4-carboxamide
PubChem CID25382765
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC NameN-ethyl-N-methyl-2-(phenoxymethyl)-1,3-oxazole-4-carboxamide
SMILESCCN(C)C(=O)c1coc(COc2ccccc2)n1
InChIInChI=1S/C14H16N2O3/c1-3-16(2)14(17)12-9-19-13(15-12)10-18-11-7-5-4-6-8-11/h4-9H,3,10H2,1-2H3
InChIKeyPRJBOMYEUFYKMH-UHFFFAOYSA-N
XLogP2.35
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-(phenoxymethyl)-1,3-oxazole-4-carboxamide?
The IUPAC name of N-ethyl-N-methyl-2-(phenoxymethyl)-1,3-oxazole-4-carboxamide (CID 25382765) is N-ethyl-N-methyl-2-(phenoxymethyl)-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-ethyl-N-methyl-2-(phenoxymethyl)-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-ethyl-N-methyl-2-(phenoxymethyl)-1,3-oxazole-4-carboxamide is CCN(C)C(=O)c1coc(COc2ccccc2)n1.
What is the InChIKey of N-ethyl-N-methyl-2-(phenoxymethyl)-1,3-oxazole-4-carboxamide?
The InChIKey is PRJBOMYEUFYKMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c1-3-16(2)14(17)12-9-19-13(15-12)10-18-11-7-5-4-6-8-11/h4-9H,3,10H2,1-2H3.
What are the key properties of N-ethyl-N-methyl-2-(phenoxymethyl)-1,3-oxazole-4-carboxamide?
N-ethyl-N-methyl-2-(phenoxymethyl)-1,3-oxazole-4-carboxamide has a molecular weight of 260.29 g/mol, XLogP of 2.35, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-(phenoxymethyl)-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 25382765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).