2-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanamide

C14H16N2O2 — CID 1484369

IUPAC2-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanamide
SMILESCC(C)C(=O)NCc1cc(-c2ccccc2)no1
InChIInChI=1S/C14H16N2O2/c1-10(2)14(17)15-9-12-8-13(16-18-12)11-6-4-3-5-7-11/h3-8,10H,9H2,1-2H3,(H,15,17)
InChIKeyFTHWHQSOIJMWOS-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.61
Rot. Bonds4

About 2-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanamide

2-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanamide (PubChem CID 1484369) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 2-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanamide
PubChem CID1484369
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name2-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanamide
SMILESCC(C)C(=O)NCc1cc(-c2ccccc2)no1
InChIInChI=1S/C14H16N2O2/c1-10(2)14(17)15-9-12-8-13(16-18-12)11-6-4-3-5-7-11/h3-8,10H,9H2,1-2H3,(H,15,17)
InChIKeyFTHWHQSOIJMWOS-UHFFFAOYSA-N
XLogP2.61
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanamide?
The IUPAC name of 2-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanamide (CID 1484369) is 2-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanamide.
What is the SMILES notation for 2-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanamide?
The canonical SMILES for 2-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanamide is CC(C)C(=O)NCc1cc(-c2ccccc2)no1.
What is the InChIKey of 2-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanamide?
The InChIKey is FTHWHQSOIJMWOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-10(2)14(17)15-9-12-8-13(16-18-12)11-6-4-3-5-7-11/h3-8,10H,9H2,1-2H3,(H,15,17).
What are the key properties of 2-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanamide?
2-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanamide has a molecular weight of 244.29 g/mol, XLogP of 2.61, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanamide is sourced from PubChem (CID 1484369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).