N-(3,5-dimethylphenyl)-2-[(2-ethoxyphenyl)methyl-methylamino]acetamide

C20H26N2O2 — CID 78899721

IUPACN-(3,5-dimethylphenyl)-2-[(2-ethoxyphenyl)methyl-methylamino]acetamide
SMILESCCOc1ccccc1CN(C)CC(=O)Nc1cc(C)cc(C)c1
InChIInChI=1S/C20H26N2O2/c1-5-24-19-9-7-6-8-17(19)13-22(4)14-20(23)21-18-11-15(2)10-16(3)12-18/h6-12H,5,13-14H2,1-4H3,(H,21,23)
InChIKeyXGONERQHOVYIOS-UHFFFAOYSA-N
MW326.44 g/mol
LogP3.77
Rot. Bonds7

About N-(3,5-dimethylphenyl)-2-[(2-ethoxyphenyl)methyl-methylamino]acetamide

N-(3,5-dimethylphenyl)-2-[(2-ethoxyphenyl)methyl-methylamino]acetamide (PubChem CID 78899721) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-2-[(2-ethoxyphenyl)methyl-methylamino]acetamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-2-[(2-ethoxyphenyl)methyl-methylamino]acetamide
PubChem CID78899721
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC NameN-(3,5-dimethylphenyl)-2-[(2-ethoxyphenyl)methyl-methylamino]acetamide
SMILESCCOc1ccccc1CN(C)CC(=O)Nc1cc(C)cc(C)c1
InChIInChI=1S/C20H26N2O2/c1-5-24-19-9-7-6-8-17(19)13-22(4)14-20(23)21-18-11-15(2)10-16(3)12-18/h6-12H,5,13-14H2,1-4H3,(H,21,23)
InChIKeyXGONERQHOVYIOS-UHFFFAOYSA-N
XLogP3.77
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-ethoxyphenyl)methyl-methylamino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 87014799
2-[[2-(3,5-dimethylanilino)-2-oxoethyl]-methylamino]-N-(2-ethylphenyl)acetamide
CID 9304031
2-[N-(benzenesulfonyl)-2-ethoxyanilino]-N-(3,5-dimethylphenyl)acetamide
CID 51345275
2-[(5-acetyl-2-ethoxyphenyl)methyl-methylamino]-N-(4-fluorophenyl)acetamide
CID 9252847
methyl 3-[(2-ethoxyphenyl)methyl-methylamino]propanoate
CID 60965925
N-(3,5-dimethoxyphenyl)-2-[(2-fluorophenyl)methyl-methylamino]acetamide
CID 18078741
2-[(4-chlorophenyl)methyl-methylamino]-N-(3,5-dimethylphenyl)acetamide
CID 2657408
2-bromo-N-[(2-ethoxyphenyl)methyl]-N-methylacetamide
CID 63678589
N-(2,6-dibromo-4-methylphenyl)-2-[(2,3-dimethoxyphenyl)methyl-methylamino]acetamide
CID 27239909
methyl 3-[(2-ethoxyphenyl)methyl-methylamino]-2-methylpropanoate
CID 60966567
N-(3-aminophenyl)-2-[(2-bromophenyl)methyl-methylamino]acetamide
CID 61416513
3-[acetyl-[(2-methoxyphenyl)methyl]amino]-N-(3,5-dimethylphenyl)propanamide
CID 113119787

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-2-[(2-ethoxyphenyl)methyl-methylamino]acetamide?
The IUPAC name of N-(3,5-dimethylphenyl)-2-[(2-ethoxyphenyl)methyl-methylamino]acetamide (CID 78899721) is N-(3,5-dimethylphenyl)-2-[(2-ethoxyphenyl)methyl-methylamino]acetamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-2-[(2-ethoxyphenyl)methyl-methylamino]acetamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-2-[(2-ethoxyphenyl)methyl-methylamino]acetamide is CCOc1ccccc1CN(C)CC(=O)Nc1cc(C)cc(C)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-2-[(2-ethoxyphenyl)methyl-methylamino]acetamide?
The InChIKey is XGONERQHOVYIOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-5-24-19-9-7-6-8-17(19)13-22(4)14-20(23)21-18-11-15(2)10-16(3)12-18/h6-12H,5,13-14H2,1-4H3,(H,21,23).
What are the key properties of N-(3,5-dimethylphenyl)-2-[(2-ethoxyphenyl)methyl-methylamino]acetamide?
N-(3,5-dimethylphenyl)-2-[(2-ethoxyphenyl)methyl-methylamino]acetamide has a molecular weight of 326.44 g/mol, XLogP of 3.77, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-2-[(2-ethoxyphenyl)methyl-methylamino]acetamide is sourced from PubChem (CID 78899721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).