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

C19H17ClN2O3 — CID 7671468

IUPAC2-(2-benzyl-4-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1cc(NC(=O)COc2ccc(Cl)cc2Cc2ccccc2)no1
InChIInChI=1S/C19H17ClN2O3/c1-13-9-18(22-25-13)21-19(23)12-24-17-8-7-16(20)11-15(17)10-14-5-3-2-4-6-14/h2-9,11H,10,12H2,1H3,(H,21,22,23)
InChIKeyXGMMSGGQNNKOHR-UHFFFAOYSA-N
MW356.81 g/mol
LogP4.24
Rot. Bonds6

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

2-(2-benzyl-4-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide (PubChem CID 7671468) has the molecular formula C19H17ClN2O3 and a molecular weight of 356.81 g/mol. Its IUPAC name is 2-(2-benzyl-4-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(2-benzyl-4-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
PubChem CID7671468
Molecular FormulaC19H17ClN2O3
Molecular Weight356.81 g/mol
Exact Mass356.09
IUPAC Name2-(2-benzyl-4-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1cc(NC(=O)COc2ccc(Cl)cc2Cc2ccccc2)no1
InChIInChI=1S/C19H17ClN2O3/c1-13-9-18(22-25-13)21-19(23)12-24-17-8-7-16(20)11-15(17)10-14-5-3-2-4-6-14/h2-9,11H,10,12H2,1H3,(H,21,22,23)
InChIKeyXGMMSGGQNNKOHR-UHFFFAOYSA-N
XLogP4.24
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.81
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethoxy]phenyl]acetic acid
CID 80723767
2-(2-benzyl-4-chlorophenoxy)-N-ethylacetamide
CID 9292846
methyl 4-chloro-2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethoxy]benzoate
CID 47021954
1-(2-benzyl-4-chlorophenoxy)propan-2-one
CID 60626538
2-(2-benzyl-4-chlorophenoxy)-N-(4-methylsulfonylphenyl)acetamide
CID 33482790
2-(3-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 2632943
2-(2-formylphenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 7762657
2-[4-chloro-2-(methylaminomethyl)phenoxy]-N-phenylacetamide
CID 43277899
[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl] 2-(2-ethylphenoxy)acetate
CID 2479657
2-(2-benzylphenoxy)-N-(4-chlorophenyl)acetamide
CID 7900618
N-(5-methyl-1,2-oxazol-3-yl)-2-(2,4,6-trichlorophenoxy)acetamide
CID 7894277
2-(2,4-dimethoxyphenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 19058874

Frequently Asked Questions

What is the IUPAC name of 2-(2-benzyl-4-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The IUPAC name of 2-(2-benzyl-4-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide (CID 7671468) is 2-(2-benzyl-4-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for 2-(2-benzyl-4-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The canonical SMILES for 2-(2-benzyl-4-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide is Cc1cc(NC(=O)COc2ccc(Cl)cc2Cc2ccccc2)no1.
What is the InChIKey of 2-(2-benzyl-4-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The InChIKey is XGMMSGGQNNKOHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O3/c1-13-9-18(22-25-13)21-19(23)12-24-17-8-7-16(20)11-15(17)10-14-5-3-2-4-6-14/h2-9,11H,10,12H2,1H3,(H,21,22,23).
What are the key properties of 2-(2-benzyl-4-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
2-(2-benzyl-4-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide has a molecular weight of 356.81 g/mol, XLogP of 4.24, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-benzyl-4-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 7671468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).