N-(4-methoxyphenyl)-2-(4-methyl-1,3-oxazol-5-yl)acetamide

C13H14N2O3 — CID 110679920

IUPACN-(4-methoxyphenyl)-2-(4-methyl-1,3-oxazol-5-yl)acetamide
SMILESCOc1ccc(NC(=O)Cc2ocnc2C)cc1
InChIInChI=1S/C13H14N2O3/c1-9-12(18-8-14-9)7-13(16)15-10-3-5-11(17-2)6-4-10/h3-6,8H,7H2,1-2H3,(H,15,16)
InChIKeyNUWOHOPMFFUVHR-UHFFFAOYSA-N
MW246.27 g/mol
LogP2.17
Rot. Bonds4

About N-(4-methoxyphenyl)-2-(4-methyl-1,3-oxazol-5-yl)acetamide

N-(4-methoxyphenyl)-2-(4-methyl-1,3-oxazol-5-yl)acetamide (PubChem CID 110679920) has the molecular formula C13H14N2O3 and a molecular weight of 246.27 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-(4-methyl-1,3-oxazol-5-yl)acetamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-(4-methyl-1,3-oxazol-5-yl)acetamide
PubChem CID110679920
Molecular FormulaC13H14N2O3
Molecular Weight246.27 g/mol
Exact Mass246.10
IUPAC NameN-(4-methoxyphenyl)-2-(4-methyl-1,3-oxazol-5-yl)acetamide
SMILESCOc1ccc(NC(=O)Cc2ocnc2C)cc1
InChIInChI=1S/C13H14N2O3/c1-9-12(18-8-14-9)7-13(16)15-10-3-5-11(17-2)6-4-10/h3-6,8H,7H2,1-2H3,(H,15,16)
InChIKeyNUWOHOPMFFUVHR-UHFFFAOYSA-N
XLogP2.17
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-(4-methyl-1,3-oxazol-5-yl)acetamide?
The IUPAC name of N-(4-methoxyphenyl)-2-(4-methyl-1,3-oxazol-5-yl)acetamide (CID 110679920) is N-(4-methoxyphenyl)-2-(4-methyl-1,3-oxazol-5-yl)acetamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-(4-methyl-1,3-oxazol-5-yl)acetamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-(4-methyl-1,3-oxazol-5-yl)acetamide is COc1ccc(NC(=O)Cc2ocnc2C)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-(4-methyl-1,3-oxazol-5-yl)acetamide?
The InChIKey is NUWOHOPMFFUVHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3/c1-9-12(18-8-14-9)7-13(16)15-10-3-5-11(17-2)6-4-10/h3-6,8H,7H2,1-2H3,(H,15,16).
What are the key properties of N-(4-methoxyphenyl)-2-(4-methyl-1,3-oxazol-5-yl)acetamide?
N-(4-methoxyphenyl)-2-(4-methyl-1,3-oxazol-5-yl)acetamide has a molecular weight of 246.27 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-(4-methyl-1,3-oxazol-5-yl)acetamide is sourced from PubChem (CID 110679920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).