methyl 2-(2-chlorophenyl)-2-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]acetate

C15H15ClN2O4 — CID 75375148

IUPACmethyl 2-(2-chlorophenyl)-2-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]acetate
SMILESCOC(=O)C(NC(=O)Cc1cc(C)on1)c1ccccc1Cl
InChIInChI=1S/C15H15ClN2O4/c1-9-7-10(18-22-9)8-13(19)17-14(15(20)21-2)11-5-3-4-6-12(11)16/h3-7,14H,8H2,1-2H3,(H,17,19)
InChIKeyAJNFADQZTARQMM-UHFFFAOYSA-N
MW322.75 g/mol
LogP2.21
Rot. Bonds5

About methyl 2-(2-chlorophenyl)-2-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]acetate

methyl 2-(2-chlorophenyl)-2-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]acetate (PubChem CID 75375148) has the molecular formula C15H15ClN2O4 and a molecular weight of 322.75 g/mol. Its IUPAC name is methyl 2-(2-chlorophenyl)-2-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]acetate.

Molecular Properties

Compound Namemethyl 2-(2-chlorophenyl)-2-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]acetate
PubChem CID75375148
Molecular FormulaC15H15ClN2O4
Molecular Weight322.75 g/mol
Exact Mass322.07
IUPAC Namemethyl 2-(2-chlorophenyl)-2-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]acetate
SMILESCOC(=O)C(NC(=O)Cc1cc(C)on1)c1ccccc1Cl
InChIInChI=1S/C15H15ClN2O4/c1-9-7-10(18-22-9)8-13(19)17-14(15(20)21-2)11-5-3-4-6-12(11)16/h3-7,14H,8H2,1-2H3,(H,17,19)
InChIKeyAJNFADQZTARQMM-UHFFFAOYSA-N
XLogP2.21
TPSA81.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.75
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze methyl 2-(2-chlorophenyl)-2-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]acetate with MolForge

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Related Compounds

N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 110622054
N-[(2S)-2-(2,6-dichlorophenyl)-2-hydroxyethyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 97069382
N-[(S)-(4-chlorophenyl)-thiophen-2-ylmethyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 124606726
2-(5-methyl-1,2-oxazol-3-yl)-N-(4-phenoxyphenyl)acetamide
CID 110425586
methyl 2-(2-chlorophenyl)-2-[(2-chlorophenyl)methylamino]acetate
CID 78845715
methyl 2-(2-chlorophenyl)-2-(ethylamino)acetate;hydrochloride
CID 141289381
N-(4-chlorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 68647812
methyl (2S)-2-(2-fluorophenyl)-2-[[2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetyl]amino]acetate
CID 96539571
methyl 2-(2-fluorophenyl)-2-[[2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetyl]amino]acetate
CID 71854721
3-[[(1S)-1-(2-chlorophenyl)ethyl]sulfonylmethyl]-5-methyl-1,2-oxazole
CID 94025461
N-[1-(4-benzylpiperazin-1-yl)propan-2-yl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 110624494
2-[1-(2-chlorophenyl)ethyl-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 51282265

Frequently Asked Questions

What is the IUPAC name of methyl 2-(2-chlorophenyl)-2-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]acetate?
The IUPAC name of methyl 2-(2-chlorophenyl)-2-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]acetate (CID 75375148) is methyl 2-(2-chlorophenyl)-2-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]acetate.
What is the SMILES notation for methyl 2-(2-chlorophenyl)-2-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]acetate?
The canonical SMILES for methyl 2-(2-chlorophenyl)-2-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]acetate is COC(=O)C(NC(=O)Cc1cc(C)on1)c1ccccc1Cl.
What is the InChIKey of methyl 2-(2-chlorophenyl)-2-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]acetate?
The InChIKey is AJNFADQZTARQMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O4/c1-9-7-10(18-22-9)8-13(19)17-14(15(20)21-2)11-5-3-4-6-12(11)16/h3-7,14H,8H2,1-2H3,(H,17,19).
What are the key properties of methyl 2-(2-chlorophenyl)-2-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]acetate?
methyl 2-(2-chlorophenyl)-2-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]acetate has a molecular weight of 322.75 g/mol, XLogP of 2.21, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(2-chlorophenyl)-2-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]acetate is sourced from PubChem (CID 75375148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).