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

C12H12N2O2 — CID 14174108

IUPACN-(3-methyl-4-phenyl-1,2-oxazol-5-yl)acetamide
SMILESCC(=O)Nc1onc(C)c1-c1ccccc1
InChIInChI=1S/C12H12N2O2/c1-8-11(10-6-4-3-5-7-10)12(16-14-8)13-9(2)15/h3-7H,1-2H3,(H,13,15)
InChIKeyKKUKRTJKTMEGQJ-UHFFFAOYSA-N
MW216.24 g/mol
LogP2.61
Rot. Bonds2

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

N-(3-methyl-4-phenyl-1,2-oxazol-5-yl)acetamide (PubChem CID 14174108) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is N-(3-methyl-4-phenyl-1,2-oxazol-5-yl)acetamide.

Molecular Properties

Compound NameN-(3-methyl-4-phenyl-1,2-oxazol-5-yl)acetamide
PubChem CID14174108
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC NameN-(3-methyl-4-phenyl-1,2-oxazol-5-yl)acetamide
SMILESCC(=O)Nc1onc(C)c1-c1ccccc1
InChIInChI=1S/C12H12N2O2/c1-8-11(10-6-4-3-5-7-10)12(16-14-8)13-9(2)15/h3-7H,1-2H3,(H,13,15)
InChIKeyKKUKRTJKTMEGQJ-UHFFFAOYSA-N
XLogP2.61
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl N-(3-methyl-4-phenyl-1,2-oxazol-5-yl)carbamate
CID 102517664
1-N,1-N-dimethyl-3-N-(3-methyl-4-phenyl-1,2-oxazol-5-yl)piperidine-1,3-dicarboxamide
CID 134714182
(2S)-2-amino-3-(1H-indol-3-yl)-N-(3-methyl-4-phenyl-1,2-oxazol-5-yl)propanamide;hydrochloride
CID 154914165
(2S)-N-[2-methyl-5-[(3-methyl-4-phenyl-1,2-oxazol-5-yl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 164639190
ethyl 3-methyl-4-phenyl-1,2-oxazole-5-carboxylate
CID 14957307
N-[3-methyl-4-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-1,2-oxazol-5-yl]acetamide
CID 53133053
N-[4-[4-methoxy-3-[(4-methylphenyl)sulfamoyl]phenyl]-3-methyl-1,2-oxazol-5-yl]acetamide
CID 53133157
N-(1,3-dimethyl-4-phenylpyrazol-5-yl)acetamide
CID 132538742
N-[4-[3-[(4-chloro-2-methylphenyl)sulfamoyl]-4-methylphenyl]-3-methyl-1,2-oxazol-5-yl]acetamide
CID 53132969
N-[4-[4-methoxy-3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3-methyl-1,2-oxazol-5-yl]acetamide
CID 53133073
[3-methyl-5-(methylamino)-1,2-oxazol-4-yl]-phenylmethanone
CID 121001224
1-[3-methyl-4-(4-methylphenyl)-1,2-oxazol-5-yl]ethanone
CID 131513513

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-4-phenyl-1,2-oxazol-5-yl)acetamide?
The IUPAC name of N-(3-methyl-4-phenyl-1,2-oxazol-5-yl)acetamide (CID 14174108) is N-(3-methyl-4-phenyl-1,2-oxazol-5-yl)acetamide.
What is the SMILES notation for N-(3-methyl-4-phenyl-1,2-oxazol-5-yl)acetamide?
The canonical SMILES for N-(3-methyl-4-phenyl-1,2-oxazol-5-yl)acetamide is CC(=O)Nc1onc(C)c1-c1ccccc1.
What is the InChIKey of N-(3-methyl-4-phenyl-1,2-oxazol-5-yl)acetamide?
The InChIKey is KKUKRTJKTMEGQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-8-11(10-6-4-3-5-7-10)12(16-14-8)13-9(2)15/h3-7H,1-2H3,(H,13,15).
What are the key properties of N-(3-methyl-4-phenyl-1,2-oxazol-5-yl)acetamide?
N-(3-methyl-4-phenyl-1,2-oxazol-5-yl)acetamide has a molecular weight of 216.24 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-4-phenyl-1,2-oxazol-5-yl)acetamide is sourced from PubChem (CID 14174108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).