2-(2,3-dimethylphenoxy)-N-[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]acetamide

C22H23N3O3 — CID 108764985

IUPAC2-(2,3-dimethylphenoxy)-N-[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]acetamide
SMILESCc1cc(C)nc(Oc2ccc(NC(=O)COc3cccc(C)c3C)cc2)n1
InChIInChI=1S/C22H23N3O3/c1-14-6-5-7-20(17(14)4)27-13-21(26)25-18-8-10-19(11-9-18)28-22-23-15(2)12-16(3)24-22/h5-12H,13H2,1-4H3,(H,25,26)
InChIKeyOVQNAXJVJPLWRK-UHFFFAOYSA-N
MW377.44 g/mol
LogP4.52
Rot. Bonds6

About 2-(2,3-dimethylphenoxy)-N-[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]acetamide

2-(2,3-dimethylphenoxy)-N-[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]acetamide (PubChem CID 108764985) has the molecular formula C22H23N3O3 and a molecular weight of 377.44 g/mol. Its IUPAC name is 2-(2,3-dimethylphenoxy)-N-[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]acetamide.

Molecular Properties

Compound Name2-(2,3-dimethylphenoxy)-N-[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]acetamide
PubChem CID108764985
Molecular FormulaC22H23N3O3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC Name2-(2,3-dimethylphenoxy)-N-[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]acetamide
SMILESCc1cc(C)nc(Oc2ccc(NC(=O)COc3cccc(C)c3C)cc2)n1
InChIInChI=1S/C22H23N3O3/c1-14-6-5-7-20(17(14)4)27-13-21(26)25-18-8-10-19(11-9-18)28-22-23-15(2)12-16(3)24-22/h5-12H,13H2,1-4H3,(H,25,26)
InChIKeyOVQNAXJVJPLWRK-UHFFFAOYSA-N
XLogP4.52
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2,3-dimethylphenoxy)-N-(4-methoxyphenyl)acetamide
CID 720608
N-[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]-2-methoxyacetamide
CID 108742534
2-(3,4-dimethylphenoxy)-N-[3-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]acetamide
CID 108767054
4-[[2-(2,3-dimethylphenoxy)acetyl]amino]benzoic acid
CID 19172685
2-(2,3-dimethylphenoxy)-N-[4-(phenylcarbamoylamino)phenyl]acetamide
CID 18164294
methyl 4-[[2-(2,3-dimethylphenoxy)acetyl]amino]benzoate
CID 720624
N-(3-amino-4-methylphenyl)-2-(2,3-dimethylphenoxy)acetamide
CID 28867346
2-(2,3-dimethylphenoxy)-N-[4-(3-phenylpropoxy)phenyl]acetamide
CID 17130266
[2-(4-ethoxyanilino)-2-oxoethyl] 2-(2,3-dimethylphenoxy)acetate
CID 7982131
2-(2,3-dimethylphenoxy)-N-(3-propoxyphenyl)acetamide
CID 17097883
2-(3-amino-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide
CID 43437876
3-[[2-(2,3-dimethylphenoxy)acetyl]amino]benzoic acid
CID 720618

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylphenoxy)-N-[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]acetamide?
The IUPAC name of 2-(2,3-dimethylphenoxy)-N-[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]acetamide (CID 108764985) is 2-(2,3-dimethylphenoxy)-N-[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]acetamide.
What is the SMILES notation for 2-(2,3-dimethylphenoxy)-N-[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]acetamide?
The canonical SMILES for 2-(2,3-dimethylphenoxy)-N-[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]acetamide is Cc1cc(C)nc(Oc2ccc(NC(=O)COc3cccc(C)c3C)cc2)n1.
What is the InChIKey of 2-(2,3-dimethylphenoxy)-N-[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]acetamide?
The InChIKey is OVQNAXJVJPLWRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3/c1-14-6-5-7-20(17(14)4)27-13-21(26)25-18-8-10-19(11-9-18)28-22-23-15(2)12-16(3)24-22/h5-12H,13H2,1-4H3,(H,25,26).
What are the key properties of 2-(2,3-dimethylphenoxy)-N-[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]acetamide?
2-(2,3-dimethylphenoxy)-N-[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]acetamide has a molecular weight of 377.44 g/mol, XLogP of 4.52, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylphenoxy)-N-[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]acetamide is sourced from PubChem (CID 108764985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).