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

C13H14N2O2 — CID 47265687

IUPAC2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide
SMILESCC(C)C(=O)Nc1cccc(-c2cnco2)c1
InChIInChI=1S/C13H14N2O2/c1-9(2)13(16)15-11-5-3-4-10(6-11)12-7-14-8-17-12/h3-9H,1-2H3,(H,15,16)
InChIKeyHRSSXTASNFAPPP-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.94
Rot. Bonds3

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

2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide (PubChem CID 47265687) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is 2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide
PubChem CID47265687
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide
SMILESCC(C)C(=O)Nc1cccc(-c2cnco2)c1
InChIInChI=1S/C13H14N2O2/c1-9(2)13(16)15-11-5-3-4-10(6-11)12-7-14-8-17-12/h3-9H,1-2H3,(H,15,16)
InChIKeyHRSSXTASNFAPPP-UHFFFAOYSA-N
XLogP2.94
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide
CID 76888066
(2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide
CID 61180352
3-amino-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide
CID 54862859
2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]hexanamide
CID 60926904
2-(methylamino)-N-[3-(1,3-oxazol-5-yl)phenyl]-3-phenylpropanamide
CID 123157870
3-methyl-5-[3-(1,3-oxazol-5-yl)anilino]-5-oxopentanoic acid
CID 62965913
(2S)-N-tert-butyl-2-[[3-(1,3-oxazol-5-yl)phenyl]carbamoylamino]propanamide
CID 95338904
3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]but-2-enamide
CID 47353684
2-(4-methoxyphenyl)sulfanyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide
CID 55991056
2-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide
CID 63678754
5-amino-N-[3-(1,3-oxazol-5-yl)phenyl]hexanamide
CID 82851895
3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide
CID 47051399

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide?
The IUPAC name of 2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide (CID 47265687) is 2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide.
What is the SMILES notation for 2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide?
The canonical SMILES for 2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide is CC(C)C(=O)Nc1cccc(-c2cnco2)c1.
What is the InChIKey of 2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide?
The InChIKey is HRSSXTASNFAPPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-9(2)13(16)15-11-5-3-4-10(6-11)12-7-14-8-17-12/h3-9H,1-2H3,(H,15,16).
What are the key properties of 2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide?
2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide has a molecular weight of 230.27 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide is sourced from PubChem (CID 47265687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).