N-(4-ethyl-1,3-oxazol-2-yl)-2-methylpropanamide

C9H14N2O2 — CID 130009737

IUPACN-(4-ethyl-1,3-oxazol-2-yl)-2-methylpropanamide
SMILESCCc1coc(NC(=O)C(C)C)n1
InChIInChI=1S/C9H14N2O2/c1-4-7-5-13-9(10-7)11-8(12)6(2)3/h5-6H,4H2,1-3H3,(H,10,11,12)
InChIKeyPJUDIEGHDVBPBS-UHFFFAOYSA-N
MW182.22 g/mol
LogP1.83
Rot. Bonds3

About N-(4-ethyl-1,3-oxazol-2-yl)-2-methylpropanamide

N-(4-ethyl-1,3-oxazol-2-yl)-2-methylpropanamide (PubChem CID 130009737) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is N-(4-ethyl-1,3-oxazol-2-yl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(4-ethyl-1,3-oxazol-2-yl)-2-methylpropanamide
PubChem CID130009737
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC NameN-(4-ethyl-1,3-oxazol-2-yl)-2-methylpropanamide
SMILESCCc1coc(NC(=O)C(C)C)n1
InChIInChI=1S/C9H14N2O2/c1-4-7-5-13-9(10-7)11-8(12)6(2)3/h5-6H,4H2,1-3H3,(H,10,11,12)
InChIKeyPJUDIEGHDVBPBS-UHFFFAOYSA-N
XLogP1.83
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-1,3-oxazol-2-yl)-2-methylpropanamide?
The IUPAC name of N-(4-ethyl-1,3-oxazol-2-yl)-2-methylpropanamide (CID 130009737) is N-(4-ethyl-1,3-oxazol-2-yl)-2-methylpropanamide.
What is the SMILES notation for N-(4-ethyl-1,3-oxazol-2-yl)-2-methylpropanamide?
The canonical SMILES for N-(4-ethyl-1,3-oxazol-2-yl)-2-methylpropanamide is CCc1coc(NC(=O)C(C)C)n1.
What is the InChIKey of N-(4-ethyl-1,3-oxazol-2-yl)-2-methylpropanamide?
The InChIKey is PJUDIEGHDVBPBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-4-7-5-13-9(10-7)11-8(12)6(2)3/h5-6H,4H2,1-3H3,(H,10,11,12).
What are the key properties of N-(4-ethyl-1,3-oxazol-2-yl)-2-methylpropanamide?
N-(4-ethyl-1,3-oxazol-2-yl)-2-methylpropanamide has a molecular weight of 182.22 g/mol, XLogP of 1.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-1,3-oxazol-2-yl)-2-methylpropanamide is sourced from PubChem (CID 130009737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).