2-(4-methylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide

C19H23NO3 — CID 43911022

IUPAC2-(4-methylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide
SMILESCc1ccc(OCC(=O)NCc2ccc(OC(C)C)cc2)cc1
InChIInChI=1S/C19H23NO3/c1-14(2)23-18-10-6-16(7-11-18)12-20-19(21)13-22-17-8-4-15(3)5-9-17/h4-11,14H,12-13H2,1-3H3,(H,20,21)
InChIKeyVSZFISNEXTYDJY-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.48
Rot. Bonds7

About 2-(4-methylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide

2-(4-methylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide (PubChem CID 43911022) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is 2-(4-methylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-methylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide
PubChem CID43911022
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name2-(4-methylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide
SMILESCc1ccc(OCC(=O)NCc2ccc(OC(C)C)cc2)cc1
InChIInChI=1S/C19H23NO3/c1-14(2)23-18-10-6-16(7-11-18)12-20-19(21)13-22-17-8-4-15(3)5-9-17/h4-11,14H,12-13H2,1-3H3,(H,20,21)
InChIKeyVSZFISNEXTYDJY-UHFFFAOYSA-N
XLogP3.48
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenoxy-N-[(4-propan-2-yloxyphenyl)methyl]acetamide
CID 28633501
N-[[4-(difluoromethoxy)phenyl]methyl]-2-(4-methylphenoxy)acetamide
CID 42005185
2-(4-tert-butylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide
CID 28633311
2-(4-iodophenoxy)-N-[(4-methylphenyl)methyl]acetamide
CID 7473183
N-[(4-propan-2-yloxyphenyl)methyl]-2-(2,3,5-trimethylphenoxy)acetamide
CID 92676497
2-(4-cyanophenoxy)-N-[(4-methylphenyl)methyl]acetamide
CID 8781293
N-[(4-methylphenyl)methyl]-2-[4-(propan-2-ylsulfamoyl)phenoxy]acetamide
CID 1319379
2-(2,3-dimethylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide
CID 43911139
N-[(4-methoxyphenyl)methyl]-2-[[2-(4-methylphenoxy)acetyl]amino]acetamide
CID 48501757
3-(4-methylphenyl)sulfanyl-N-[(4-propan-2-yloxyphenyl)methyl]propanamide
CID 30380045
2-[4-(4-methylphenoxy)phenoxy]-N-[[4-(propan-2-ylsulfamoylmethyl)phenyl]methyl]acetamide
CID 24633590
2-[4-(2-methylbutan-2-yl)phenoxy]-N-[(4-methylphenyl)methyl]acetamide
CID 46761744

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide?
The IUPAC name of 2-(4-methylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide (CID 43911022) is 2-(4-methylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-(4-methylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide?
The canonical SMILES for 2-(4-methylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide is Cc1ccc(OCC(=O)NCc2ccc(OC(C)C)cc2)cc1.
What is the InChIKey of 2-(4-methylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide?
The InChIKey is VSZFISNEXTYDJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-14(2)23-18-10-6-16(7-11-18)12-20-19(21)13-22-17-8-4-15(3)5-9-17/h4-11,14H,12-13H2,1-3H3,(H,20,21).
What are the key properties of 2-(4-methylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide?
2-(4-methylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide has a molecular weight of 313.40 g/mol, XLogP of 3.48, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide is sourced from PubChem (CID 43911022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).