2-[[2-(2-benzylphenoxy)acetyl]-methylamino]acetamide

C18H20N2O3 — CID 56813072

IUPAC2-[[2-(2-benzylphenoxy)acetyl]-methylamino]acetamide
SMILESCN(CC(N)=O)C(=O)COc1ccccc1Cc1ccccc1
InChIInChI=1S/C18H20N2O3/c1-20(12-17(19)21)18(22)13-23-16-10-6-5-9-15(16)11-14-7-3-2-4-8-14/h2-10H,11-13H2,1H3,(H2,19,21)
InChIKeySGCFHZCIMSQWGC-UHFFFAOYSA-N
MW312.37 g/mol
LogP1.60
Rot. Bonds7

About 2-[[2-(2-benzylphenoxy)acetyl]-methylamino]acetamide

2-[[2-(2-benzylphenoxy)acetyl]-methylamino]acetamide (PubChem CID 56813072) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is 2-[[2-(2-benzylphenoxy)acetyl]-methylamino]acetamide.

Molecular Properties

Compound Name2-[[2-(2-benzylphenoxy)acetyl]-methylamino]acetamide
PubChem CID56813072
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC Name2-[[2-(2-benzylphenoxy)acetyl]-methylamino]acetamide
SMILESCN(CC(N)=O)C(=O)COc1ccccc1Cc1ccccc1
InChIInChI=1S/C18H20N2O3/c1-20(12-17(19)21)18(22)13-23-16-10-6-5-9-15(16)11-14-7-3-2-4-8-14/h2-10H,11-13H2,1H3,(H2,19,21)
InChIKeySGCFHZCIMSQWGC-UHFFFAOYSA-N
XLogP1.60
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(2-cyanophenoxy)acetyl]-methylamino]acetamide
CID 43374251
2-(2-benzylphenoxy)-N-[(2-chloro-6-fluorophenyl)methyl]-N-methylacetamide
CID 7936316
N-(1,3-benzothiazol-2-ylmethyl)-2-(2-benzylphenoxy)-N-methylacetamide
CID 9372728
2-(2-benzylphenoxy)-N-methylacetamide
CID 7661700
methyl 2-(2-benzylphenoxy)acetate
CID 43237517
2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]acetamide
CID 56809046
(3S)-N-(2-amino-2-oxoethyl)-N,3-dimethyl-5-phenylpentanamide
CID 94219124
2-(2-benzylphenoxy)-N-[4-(carbamoylamino)phenyl]acetamide
CID 33152514
2-(2-ethylphenoxy)-N-methylacetohydrazide
CID 116820495
2-[[2-[4-(aminomethyl)phenoxy]acetyl]-methylamino]acetamide
CID 43373935
1-(4-acetylpiperazin-1-yl)-2-(2-benzylphenoxy)ethanone
CID 78767258
2-(2-benzylphenoxy)-N-methylsulfonylacetamide
CID 134106534

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-benzylphenoxy)acetyl]-methylamino]acetamide?
The IUPAC name of 2-[[2-(2-benzylphenoxy)acetyl]-methylamino]acetamide (CID 56813072) is 2-[[2-(2-benzylphenoxy)acetyl]-methylamino]acetamide.
What is the SMILES notation for 2-[[2-(2-benzylphenoxy)acetyl]-methylamino]acetamide?
The canonical SMILES for 2-[[2-(2-benzylphenoxy)acetyl]-methylamino]acetamide is CN(CC(N)=O)C(=O)COc1ccccc1Cc1ccccc1.
What is the InChIKey of 2-[[2-(2-benzylphenoxy)acetyl]-methylamino]acetamide?
The InChIKey is SGCFHZCIMSQWGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-20(12-17(19)21)18(22)13-23-16-10-6-5-9-15(16)11-14-7-3-2-4-8-14/h2-10H,11-13H2,1H3,(H2,19,21).
What are the key properties of 2-[[2-(2-benzylphenoxy)acetyl]-methylamino]acetamide?
2-[[2-(2-benzylphenoxy)acetyl]-methylamino]acetamide has a molecular weight of 312.37 g/mol, XLogP of 1.60, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-benzylphenoxy)acetyl]-methylamino]acetamide is sourced from PubChem (CID 56813072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).