3-ethyl-N-methyl-5-(2-oxo-2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide

C14H15N3O3 — CID 22762089

IUPAC3-ethyl-N-methyl-5-(2-oxo-2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide
SMILESCCc1noc(CC(=O)c2ccncc2)c1C(=O)NC
InChIInChI=1S/C14H15N3O3/c1-3-10-13(14(19)15-2)12(20-17-10)8-11(18)9-4-6-16-7-5-9/h4-7H,3,8H2,1-2H3,(H,15,19)
InChIKeyBWVXBLWCGWXWDS-UHFFFAOYSA-N
MW273.29 g/mol
LogP1.42
Rot. Bonds5

About 3-ethyl-N-methyl-5-(2-oxo-2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide

3-ethyl-N-methyl-5-(2-oxo-2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide (PubChem CID 22762089) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is 3-ethyl-N-methyl-5-(2-oxo-2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-methyl-5-(2-oxo-2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide
PubChem CID22762089
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Name3-ethyl-N-methyl-5-(2-oxo-2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide
SMILESCCc1noc(CC(=O)c2ccncc2)c1C(=O)NC
InChIInChI=1S/C14H15N3O3/c1-3-10-13(14(19)15-2)12(20-17-10)8-11(18)9-4-6-16-7-5-9/h4-7H,3,8H2,1-2H3,(H,15,19)
InChIKeyBWVXBLWCGWXWDS-UHFFFAOYSA-N
XLogP1.42
TPSA85.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-methyl-5-(2-oxo-2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide?
The IUPAC name of 3-ethyl-N-methyl-5-(2-oxo-2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide (CID 22762089) is 3-ethyl-N-methyl-5-(2-oxo-2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 3-ethyl-N-methyl-5-(2-oxo-2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide?
The canonical SMILES for 3-ethyl-N-methyl-5-(2-oxo-2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide is CCc1noc(CC(=O)c2ccncc2)c1C(=O)NC.
What is the InChIKey of 3-ethyl-N-methyl-5-(2-oxo-2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide?
The InChIKey is BWVXBLWCGWXWDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c1-3-10-13(14(19)15-2)12(20-17-10)8-11(18)9-4-6-16-7-5-9/h4-7H,3,8H2,1-2H3,(H,15,19).
What are the key properties of 3-ethyl-N-methyl-5-(2-oxo-2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide?
3-ethyl-N-methyl-5-(2-oxo-2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide has a molecular weight of 273.29 g/mol, XLogP of 1.42, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-methyl-5-(2-oxo-2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 22762089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).