N-[1-(4-methoxyphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)acetamide

C21H27NO4 — CID 132653925

IUPACN-[1-(4-methoxyphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)acetamide
SMILESCOc1ccc(OCC(C)NC(=O)COc2cc(C)cc(C)c2C)cc1
InChIInChI=1S/C21H27NO4/c1-14-10-15(2)17(4)20(11-14)26-13-21(23)22-16(3)12-25-19-8-6-18(24-5)7-9-19/h6-11,16H,12-13H2,1-5H3,(H,22,23)
InChIKeyXRZVYANVSWJXPS-UHFFFAOYSA-N
MW357.45 g/mol
LogP3.58
Rot. Bonds8

About N-[1-(4-methoxyphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)acetamide

N-[1-(4-methoxyphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)acetamide (PubChem CID 132653925) has the molecular formula C21H27NO4 and a molecular weight of 357.45 g/mol. Its IUPAC name is N-[1-(4-methoxyphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-[1-(4-methoxyphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)acetamide
PubChem CID132653925
Molecular FormulaC21H27NO4
Molecular Weight357.45 g/mol
Exact Mass357.19
IUPAC NameN-[1-(4-methoxyphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)acetamide
SMILESCOc1ccc(OCC(C)NC(=O)COc2cc(C)cc(C)c2C)cc1
InChIInChI=1S/C21H27NO4/c1-14-10-15(2)17(4)20(11-14)26-13-21(23)22-16(3)12-25-19-8-6-18(24-5)7-9-19/h6-11,16H,12-13H2,1-5H3,(H,22,23)
InChIKeyXRZVYANVSWJXPS-UHFFFAOYSA-N
XLogP3.58
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.45
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-N-[(2R)-1-(4-methoxyphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)propanamide
CID 93486437
N-[1-(2-methylphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)acetamide
CID 132652265
2-(2,4-dichlorophenoxy)-N-[1-(4-methoxyphenoxy)propan-2-yl]acetamide
CID 132657832
2-(3-methoxyphenoxy)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide
CID 132651357
N-[(2R)-1-(4-methoxyphenoxy)propan-2-yl]-2-(4-methylphenyl)acetamide
CID 92680005
(2S)-2-[[2-(2,3,5-trimethylphenoxy)acetyl]amino]propanoate
CID 9156910
N-[1-(4-methylphenoxy)propan-2-yl]-2-naphthalen-2-yloxyacetamide
CID 132652959
2-(3,5-dimethoxyphenoxy)-N-[1-(2-methylphenoxy)propan-2-yl]acetamide
CID 132654122
N-[(2R)-1-hydroxypropan-2-yl]-2-(4-methoxyphenoxy)acetamide
CID 79031134
(2R)-N-[(2S)-butan-2-yl]-2-[(4-methoxyphenyl)methyl-[2-(2,3,5-trimethylphenoxy)acetyl]amino]propanamide
CID 100619982
N-(1-aminopropan-2-yl)-2-(4-methoxyphenoxy)acetamide
CID 110834177
2-(2-acetyl-5-methylphenoxy)-N-(1-methoxypropan-2-yl)acetamide
CID 60701152

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxyphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)acetamide?
The IUPAC name of N-[1-(4-methoxyphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)acetamide (CID 132653925) is N-[1-(4-methoxyphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)acetamide.
What is the SMILES notation for N-[1-(4-methoxyphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)acetamide?
The canonical SMILES for N-[1-(4-methoxyphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)acetamide is COc1ccc(OCC(C)NC(=O)COc2cc(C)cc(C)c2C)cc1.
What is the InChIKey of N-[1-(4-methoxyphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)acetamide?
The InChIKey is XRZVYANVSWJXPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27NO4/c1-14-10-15(2)17(4)20(11-14)26-13-21(23)22-16(3)12-25-19-8-6-18(24-5)7-9-19/h6-11,16H,12-13H2,1-5H3,(H,22,23).
What are the key properties of N-[1-(4-methoxyphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)acetamide?
N-[1-(4-methoxyphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)acetamide has a molecular weight of 357.45 g/mol, XLogP of 3.58, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxyphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)acetamide is sourced from PubChem (CID 132653925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).