2-[2-[(dimethylamino)methyl]-4-phenylphenoxy]-N-[(2-methoxyphenyl)methyl]acetamide

C25H28N2O3 — CID 42481778

IUPAC2-[2-[(dimethylamino)methyl]-4-phenylphenoxy]-N-[(2-methoxyphenyl)methyl]acetamide
SMILESCOc1ccccc1CNC(=O)COc1ccc(-c2ccccc2)cc1CN(C)C
InChIInChI=1S/C25H28N2O3/c1-27(2)17-22-15-20(19-9-5-4-6-10-19)13-14-24(22)30-18-25(28)26-16-21-11-7-8-12-23(21)29-3/h4-15H,16-18H2,1-3H3,(H,26,28)
InChIKeyUXTHGEQDILNFJD-UHFFFAOYSA-N
MW404.51 g/mol
LogP4.12
Rot. Bonds9

About 2-[2-[(dimethylamino)methyl]-4-phenylphenoxy]-N-[(2-methoxyphenyl)methyl]acetamide

2-[2-[(dimethylamino)methyl]-4-phenylphenoxy]-N-[(2-methoxyphenyl)methyl]acetamide (PubChem CID 42481778) has the molecular formula C25H28N2O3 and a molecular weight of 404.51 g/mol. Its IUPAC name is 2-[2-[(dimethylamino)methyl]-4-phenylphenoxy]-N-[(2-methoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-[2-[(dimethylamino)methyl]-4-phenylphenoxy]-N-[(2-methoxyphenyl)methyl]acetamide
PubChem CID42481778
Molecular FormulaC25H28N2O3
Molecular Weight404.51 g/mol
Exact Mass404.21
IUPAC Name2-[2-[(dimethylamino)methyl]-4-phenylphenoxy]-N-[(2-methoxyphenyl)methyl]acetamide
SMILESCOc1ccccc1CNC(=O)COc1ccc(-c2ccccc2)cc1CN(C)C
InChIInChI=1S/C25H28N2O3/c1-27(2)17-22-15-20(19-9-5-4-6-10-19)13-14-24(22)30-18-25(28)26-16-21-11-7-8-12-23(21)29-3/h4-15H,16-18H2,1-3H3,(H,26,28)
InChIKeyUXTHGEQDILNFJD-UHFFFAOYSA-N
XLogP4.12
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.51
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-ethylphenoxy)-N-[(2-methoxyphenyl)methyl]acetamide
CID 2709267
N-[(2-methoxyphenyl)methyl]-2-(2,4,5-trimethylphenoxy)acetamide
CID 112978023
N-[(2-methoxyphenyl)methyl]-2-(4-phenoxyphenoxy)acetamide
CID 7610854
2-(5-chloro-2-methoxyphenyl)-N-[[2-[(dimethylamino)methyl]phenyl]methyl]acetamide
CID 9069509
[2-[(2-methoxyphenyl)methylamino]-2-oxoethyl] 4-(4-hydroxyphenyl)benzoate
CID 2644716
[2-[(2-methoxyphenyl)methylamino]-2-oxoethyl] 4-oxo-4-(4-phenylphenyl)butanoate
CID 55404534
2-(7-methoxynaphthalen-2-yl)oxy-N-[(2-methoxyphenyl)methyl]acetamide
CID 7652672
N-[(2-methoxyphenyl)methyl]-3-phenoxypropanamide
CID 26734453
2-anilino-N-[(2-methoxyphenyl)methyl]acetamide
CID 60646954
2-[2-[[3-(3-fluoro-4-methoxyphenyl)propanoylamino]methyl]phenoxy]acetic acid
CID 75429383
N-[(2-methoxyphenyl)methyl]-5-phenylpyridine-2-carboxamide
CID 110683577
3-(2-methoxyphenyl)-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide
CID 9470380

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(dimethylamino)methyl]-4-phenylphenoxy]-N-[(2-methoxyphenyl)methyl]acetamide?
The IUPAC name of 2-[2-[(dimethylamino)methyl]-4-phenylphenoxy]-N-[(2-methoxyphenyl)methyl]acetamide (CID 42481778) is 2-[2-[(dimethylamino)methyl]-4-phenylphenoxy]-N-[(2-methoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-[2-[(dimethylamino)methyl]-4-phenylphenoxy]-N-[(2-methoxyphenyl)methyl]acetamide?
The canonical SMILES for 2-[2-[(dimethylamino)methyl]-4-phenylphenoxy]-N-[(2-methoxyphenyl)methyl]acetamide is COc1ccccc1CNC(=O)COc1ccc(-c2ccccc2)cc1CN(C)C.
What is the InChIKey of 2-[2-[(dimethylamino)methyl]-4-phenylphenoxy]-N-[(2-methoxyphenyl)methyl]acetamide?
The InChIKey is UXTHGEQDILNFJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2O3/c1-27(2)17-22-15-20(19-9-5-4-6-10-19)13-14-24(22)30-18-25(28)26-16-21-11-7-8-12-23(21)29-3/h4-15H,16-18H2,1-3H3,(H,26,28).
What are the key properties of 2-[2-[(dimethylamino)methyl]-4-phenylphenoxy]-N-[(2-methoxyphenyl)methyl]acetamide?
2-[2-[(dimethylamino)methyl]-4-phenylphenoxy]-N-[(2-methoxyphenyl)methyl]acetamide has a molecular weight of 404.51 g/mol, XLogP of 4.12, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(dimethylamino)methyl]-4-phenylphenoxy]-N-[(2-methoxyphenyl)methyl]acetamide is sourced from PubChem (CID 42481778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).