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

C11H12N2O2 — CID 121221970

IUPACN-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)acetamide
SMILESCC(=O)NC1=NOC(c2ccccc2)C1
InChIInChI=1S/C11H12N2O2/c1-8(14)12-11-7-10(15-13-11)9-5-3-2-4-6-9/h2-6,10H,7H2,1H3,(H,12,13,14)
InChIKeyJPKZJULGNFPHNN-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.60
Rot. Bonds1

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

N-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)acetamide (PubChem CID 121221970) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is N-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)acetamide
PubChem CID121221970
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC NameN-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)acetamide
SMILESCC(=O)NC1=NOC(c2ccccc2)C1
InChIInChI=1S/C11H12N2O2/c1-8(14)12-11-7-10(15-13-11)9-5-3-2-4-6-9/h2-6,10H,7H2,1H3,(H,12,13,14)
InChIKeyJPKZJULGNFPHNN-UHFFFAOYSA-N
XLogP1.60
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-[[(5S)-5-(4-phenoxyphenyl)-4,5-dihydro-1,2-oxazol-3-yl]oxy]-2-pyridinyl]acetamide
CID 88979580
ethyl (5-phenyl-4,5-dihydro-1,2-oxazol-3-yl) carbonate
CID 23064923
5-(4-methylphenyl)-N-phenyl-4,5-dihydro-1,2-oxazole-3-carboxamide
CID 167930152
5-phenyl-N-pyridin-2-yl-4,5-dihydro-1,2-oxazole-3-carboxamide
CID 167954246
2-bromo-1-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)ethanone
CID 87557465
3-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)propanoic acid
CID 155819586
trans-methyl (1R,3S)-1,2,2-trimethyl-3-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)cyclopentane-1-carboxylate
CID 51031999
(5S)-3-bromo-5-phenyl-4,5-dihydro-1,2-oxazole;(5R)-3-bromo-5-phenyl-4,5-dihydro-1,2-oxazole
CID 159139120
(5R)-5-phenyl-N-(1-propan-2-ylpyrazol-4-yl)-4,5-dihydro-1,2-oxazole-3-carboxamide
CID 95171775
(5S)-N',N',5-triphenyl-4,5-dihydro-1,2-oxazole-3-carbohydrazide
CID 95062084
(5R)-5-phenyl-3-propan-2-yl-4,5-dihydro-1,2-oxazole
CID 15939754
4-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)benzoic acid
CID 71415133

Frequently Asked Questions

What is the IUPAC name of N-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)acetamide?
The IUPAC name of N-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)acetamide (CID 121221970) is N-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for N-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)acetamide?
The canonical SMILES for N-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)acetamide is CC(=O)NC1=NOC(c2ccccc2)C1.
What is the InChIKey of N-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)acetamide?
The InChIKey is JPKZJULGNFPHNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-8(14)12-11-7-10(15-13-11)9-5-3-2-4-6-9/h2-6,10H,7H2,1H3,(H,12,13,14).
What are the key properties of N-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)acetamide?
N-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)acetamide has a molecular weight of 204.23 g/mol, XLogP of 1.60, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 121221970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).