2-ethyl-4-methyl-N-[(1-propan-2-ylimidazol-2-yl)methyl]-1,3-oxazole-5-carboxamide

C14H20N4O2 — CID 122563117

IUPAC2-ethyl-4-methyl-N-[(1-propan-2-ylimidazol-2-yl)methyl]-1,3-oxazole-5-carboxamide
SMILESCCc1nc(C)c(C(=O)NCc2nccn2C(C)C)o1
InChIInChI=1S/C14H20N4O2/c1-5-12-17-10(4)13(20-12)14(19)16-8-11-15-6-7-18(11)9(2)3/h6-7,9H,5,8H2,1-4H3,(H,16,19)
InChIKeyRUWUTDCTPUXLLU-UHFFFAOYSA-N
MW276.34 g/mol
LogP2.25
Rot. Bonds5

About 2-ethyl-4-methyl-N-[(1-propan-2-ylimidazol-2-yl)methyl]-1,3-oxazole-5-carboxamide

2-ethyl-4-methyl-N-[(1-propan-2-ylimidazol-2-yl)methyl]-1,3-oxazole-5-carboxamide (PubChem CID 122563117) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 2-ethyl-4-methyl-N-[(1-propan-2-ylimidazol-2-yl)methyl]-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound Name2-ethyl-4-methyl-N-[(1-propan-2-ylimidazol-2-yl)methyl]-1,3-oxazole-5-carboxamide
PubChem CID122563117
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name2-ethyl-4-methyl-N-[(1-propan-2-ylimidazol-2-yl)methyl]-1,3-oxazole-5-carboxamide
SMILESCCc1nc(C)c(C(=O)NCc2nccn2C(C)C)o1
InChIInChI=1S/C14H20N4O2/c1-5-12-17-10(4)13(20-12)14(19)16-8-11-15-6-7-18(11)9(2)3/h6-7,9H,5,8H2,1-4H3,(H,16,19)
InChIKeyRUWUTDCTPUXLLU-UHFFFAOYSA-N
XLogP2.25
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-ethyl-4-methyl-N-[(1-propan-2-ylimidazol-2-yl)methyl]-1,3-oxazole-5-carboxamide 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 2-ethyl-4-methyl-N-[(1-propan-2-ylimidazol-2-yl)methyl]-1,3-oxazole-5-carboxamide?
The IUPAC name of 2-ethyl-4-methyl-N-[(1-propan-2-ylimidazol-2-yl)methyl]-1,3-oxazole-5-carboxamide (CID 122563117) is 2-ethyl-4-methyl-N-[(1-propan-2-ylimidazol-2-yl)methyl]-1,3-oxazole-5-carboxamide.
What is the SMILES notation for 2-ethyl-4-methyl-N-[(1-propan-2-ylimidazol-2-yl)methyl]-1,3-oxazole-5-carboxamide?
The canonical SMILES for 2-ethyl-4-methyl-N-[(1-propan-2-ylimidazol-2-yl)methyl]-1,3-oxazole-5-carboxamide is CCc1nc(C)c(C(=O)NCc2nccn2C(C)C)o1.
What is the InChIKey of 2-ethyl-4-methyl-N-[(1-propan-2-ylimidazol-2-yl)methyl]-1,3-oxazole-5-carboxamide?
The InChIKey is RUWUTDCTPUXLLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-5-12-17-10(4)13(20-12)14(19)16-8-11-15-6-7-18(11)9(2)3/h6-7,9H,5,8H2,1-4H3,(H,16,19).
What are the key properties of 2-ethyl-4-methyl-N-[(1-propan-2-ylimidazol-2-yl)methyl]-1,3-oxazole-5-carboxamide?
2-ethyl-4-methyl-N-[(1-propan-2-ylimidazol-2-yl)methyl]-1,3-oxazole-5-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-methyl-N-[(1-propan-2-ylimidazol-2-yl)methyl]-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 122563117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).