N-benzyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide

C14H16N2O2 — CID 18194355

IUPACN-benzyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
SMILESCc1noc(C)c1CC(=O)NCc1ccccc1
InChIInChI=1S/C14H16N2O2/c1-10-13(11(2)18-16-10)8-14(17)15-9-12-6-4-3-5-7-12/h3-7H,8-9H2,1-2H3,(H,15,17)
InChIKeyARBSNIBQFLFZDT-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.15
Rot. Bonds4

About N-benzyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide

N-benzyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide (PubChem CID 18194355) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is N-benzyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide.

Molecular Properties

Compound NameN-benzyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
PubChem CID18194355
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC NameN-benzyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
SMILESCc1noc(C)c1CC(=O)NCc1ccccc1
InChIInChI=1S/C14H16N2O2/c1-10-13(11(2)18-16-10)8-14(17)15-9-12-6-4-3-5-7-12/h3-7H,8-9H2,1-2H3,(H,15,17)
InChIKeyARBSNIBQFLFZDT-UHFFFAOYSA-N
XLogP2.15
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 ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(4-methoxyphenyl)methyl]acetamide
CID 30272063
3-[[[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]amino]methyl]-1-benzofuran-2-carboxylic acid
CID 138044123
N-[(2-chloro-6-methylphenyl)methyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 23654563
3-[[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]amino]-2-phenylpropanoic acid
CID 119254605
N-[2-(diethylamino)-3-phenylpropyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 43067553
5-[[[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]amino]methyl]-2-methoxybenzoic acid
CID 75459956
N-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2-oxoethyl]benzamide
CID 47935404
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide
CID 111119841
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-hydroxy-3-phenylpropyl)acetamide
CID 111471637
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1H-pyrazol-5-ylmethyl)acetamide
CID 47205239
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2,3,4-trifluorophenyl)methyl]acetamide
CID 23654562
N-(3-amino-3-phenylpropyl)-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 80505661

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide?
The IUPAC name of N-benzyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide (CID 18194355) is N-benzyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide.
What is the SMILES notation for N-benzyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide?
The canonical SMILES for N-benzyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide is Cc1noc(C)c1CC(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide?
The InChIKey is ARBSNIBQFLFZDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-10-13(11(2)18-16-10)8-14(17)15-9-12-6-4-3-5-7-12/h3-7H,8-9H2,1-2H3,(H,15,17).
What are the key properties of N-benzyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide?
N-benzyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide has a molecular weight of 244.29 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide is sourced from PubChem (CID 18194355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).