2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-prop-2-enylacetamide

C15H16N2O3 — CID 16879106

IUPAC2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-prop-2-enylacetamide
SMILESC=CCNC(=O)Cc1cc(-c2ccc(OC)cc2)on1
InChIInChI=1S/C15H16N2O3/c1-3-8-16-15(18)10-12-9-14(20-17-12)11-4-6-13(19-2)7-5-11/h3-7,9H,1,8,10H2,2H3,(H,16,18)
InChIKeyPCISBTYLAWFDNI-UHFFFAOYSA-N
MW272.30 g/mol
LogP2.19
Rot. Bonds6

About 2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-prop-2-enylacetamide

2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-prop-2-enylacetamide (PubChem CID 16879106) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is 2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-prop-2-enylacetamide.

Molecular Properties

Compound Name2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-prop-2-enylacetamide
PubChem CID16879106
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC Name2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-prop-2-enylacetamide
SMILESC=CCNC(=O)Cc1cc(-c2ccc(OC)cc2)on1
InChIInChI=1S/C15H16N2O3/c1-3-8-16-15(18)10-12-9-14(20-17-12)11-4-6-13(19-2)7-5-11/h3-7,9H,1,8,10H2,2H3,(H,16,18)
InChIKeyPCISBTYLAWFDNI-UHFFFAOYSA-N
XLogP2.19
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-propan-2-ylacetamide
CID 16879102
2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-octylacetamide
CID 16879241
N-[3-(diethylamino)propyl]-2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]acetamide
CID 16879115
N-(4-methoxyphenyl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
CID 16878325
2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-(1,3-thiazol-2-yl)acetamide
CID 16879227
4-methoxy-N-[[5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl]benzamide
CID 16866605
N-(3-chloro-2-methylphenyl)-2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]acetamide
CID 16879203
2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(2-methoxyethyl)acetamide
CID 16878595
2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-(3-nitrophenyl)acetamide
CID 16879164
3-ethyl-5-(4-methoxyphenyl)-1,2-oxazole
CID 59226263
N-[4-fluoro-3-(trifluoromethyl)phenyl]-2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]acetamide
CID 16879212
2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]-N-(3-methoxypropyl)acetamide
CID 16878767

Frequently Asked Questions

What is the IUPAC name of 2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-prop-2-enylacetamide?
The IUPAC name of 2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-prop-2-enylacetamide (CID 16879106) is 2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-prop-2-enylacetamide.
What is the SMILES notation for 2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-prop-2-enylacetamide?
The canonical SMILES for 2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-prop-2-enylacetamide is C=CCNC(=O)Cc1cc(-c2ccc(OC)cc2)on1.
What is the InChIKey of 2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-prop-2-enylacetamide?
The InChIKey is PCISBTYLAWFDNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-3-8-16-15(18)10-12-9-14(20-17-12)11-4-6-13(19-2)7-5-11/h3-7,9H,1,8,10H2,2H3,(H,16,18).
What are the key properties of 2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-prop-2-enylacetamide?
2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-prop-2-enylacetamide has a molecular weight of 272.30 g/mol, XLogP of 2.19, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]-N-prop-2-enylacetamide is sourced from PubChem (CID 16879106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).