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

C12H11ClN2O2 — CID 68647812

IUPACN-(4-chlorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1cc(CC(=O)Nc2ccc(Cl)cc2)no1
InChIInChI=1S/C12H11ClN2O2/c1-8-6-11(15-17-8)7-12(16)14-10-4-2-9(13)3-5-10/h2-6H,7H2,1H3,(H,14,16)
InChIKeyQUHWQBGCLBBXDE-UHFFFAOYSA-N
MW250.69 g/mol
LogP2.82
Rot. Bonds3

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

N-(4-chlorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide (PubChem CID 68647812) has the molecular formula C12H11ClN2O2 and a molecular weight of 250.69 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide
PubChem CID68647812
Molecular FormulaC12H11ClN2O2
Molecular Weight250.69 g/mol
Exact Mass250.05
IUPAC NameN-(4-chlorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1cc(CC(=O)Nc2ccc(Cl)cc2)no1
InChIInChI=1S/C12H11ClN2O2/c1-8-6-11(15-17-8)7-12(16)14-10-4-2-9(13)3-5-10/h2-6H,7H2,1H3,(H,14,16)
InChIKeyQUHWQBGCLBBXDE-UHFFFAOYSA-N
XLogP2.82
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.69
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-difluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 110428961
N-(4-bromophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 110421673
2-(5-methyl-1,2-oxazol-3-yl)-N-(4-phenoxyphenyl)acetamide
CID 110425586
1-(4-chlorophenyl)-3-[(5-methyl-1,2-oxazol-3-yl)methyl]urea
CID 110747513
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 110427091
2-(5-methyl-1,2-oxazol-3-yl)-N-(4-piperidin-1-ylphenyl)acetamide
CID 110424986
2-(5-methyl-1,2-oxazol-3-yl)-N-(3-methylphenyl)acetamide
CID 110417275
(2R)-2-methyl-3-[4-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]phenyl]propanoic acid
CID 129401481
2-(5-methyl-1,2-oxazol-3-yl)-N-[4-[[(1S)-1-phenylethyl]amino]phenyl]acetamide
CID 124505289
2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-[4-(dimethylamino)phenyl]acetamide
CID 16878662
N-(3-bromo-5-methylphenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 110614176
2-(5-methyl-1,2-oxazol-3-yl)-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]acetamide
CID 110621001

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide?
The IUPAC name of N-(4-chlorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide (CID 68647812) is N-(4-chlorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide?
The canonical SMILES for N-(4-chlorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide is Cc1cc(CC(=O)Nc2ccc(Cl)cc2)no1.
What is the InChIKey of N-(4-chlorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide?
The InChIKey is QUHWQBGCLBBXDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2O2/c1-8-6-11(15-17-8)7-12(16)14-10-4-2-9(13)3-5-10/h2-6H,7H2,1H3,(H,14,16).
What are the key properties of N-(4-chlorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide?
N-(4-chlorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide has a molecular weight of 250.69 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 68647812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).