methyl 2-[(2-methoxy-2-phenylacetyl)-methylamino]acetate

C13H17NO4 — CID 60777893

IUPACmethyl 2-[(2-methoxy-2-phenylacetyl)-methylamino]acetate
SMILESCOC(=O)CN(C)C(=O)C(OC)c1ccccc1
InChIInChI=1S/C13H17NO4/c1-14(9-11(15)17-2)13(16)12(18-3)10-7-5-4-6-8-10/h4-8,12H,9H2,1-3H3
InChIKeyFLTKVOPLFZOWDG-UHFFFAOYSA-N
MW251.28 g/mol
LogP1.01
Rot. Bonds5

About methyl 2-[(2-methoxy-2-phenylacetyl)-methylamino]acetate

methyl 2-[(2-methoxy-2-phenylacetyl)-methylamino]acetate (PubChem CID 60777893) has the molecular formula C13H17NO4 and a molecular weight of 251.28 g/mol. Its IUPAC name is methyl 2-[(2-methoxy-2-phenylacetyl)-methylamino]acetate.

Molecular Properties

Compound Namemethyl 2-[(2-methoxy-2-phenylacetyl)-methylamino]acetate
PubChem CID60777893
Molecular FormulaC13H17NO4
Molecular Weight251.28 g/mol
Exact Mass251.12
IUPAC Namemethyl 2-[(2-methoxy-2-phenylacetyl)-methylamino]acetate
SMILESCOC(=O)CN(C)C(=O)C(OC)c1ccccc1
InChIInChI=1S/C13H17NO4/c1-14(9-11(15)17-2)13(16)12(18-3)10-7-5-4-6-8-10/h4-8,12H,9H2,1-3H3
InChIKeyFLTKVOPLFZOWDG-UHFFFAOYSA-N
XLogP1.01
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.28
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2-methoxy-2-phenylacetyl)-methylamino]acetic acid
CID 62098562
methyl 2-[methyl(2-phenylpropanoyl)amino]acetate
CID 104916610
methyl 2-[[(2S)-2-amino-2-phenylacetyl]-methylamino]acetate
CID 93373727
methyl 2-[methyl(2-phenylbutanoyl)amino]acetate
CID 43422766
3-[(2-methoxy-2-phenylacetyl)-methylamino]-2-methylpropanoic acid
CID 55038053
N-(cyanomethyl)-2-methoxy-N-methyl-2-phenylacetamide
CID 60606606
(2S)-2-methoxy-N-methyl-2-phenyl-N-(pyridin-4-ylmethyl)acetamide
CID 95631182
(2R)-2-methoxy-N-methyl-2-phenyl-N-(pyridin-4-ylmethyl)acetamide
CID 95631181
2-methoxy-N-methyl-2-phenyl-N-(pyrrolidin-2-ylmethyl)acetamide
CID 106607603
2-methoxy-N-methyl-2-phenyl-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide
CID 64511674
(2S)-N-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-phenoxy-2-phenylacetamide
CID 94818236
methyl 2-[methyl-[(3R)-3-(2-methylphenyl)-3-phenylpropanoyl]amino]acetate
CID 42192377

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(2-methoxy-2-phenylacetyl)-methylamino]acetate?
The IUPAC name of methyl 2-[(2-methoxy-2-phenylacetyl)-methylamino]acetate (CID 60777893) is methyl 2-[(2-methoxy-2-phenylacetyl)-methylamino]acetate.
What is the SMILES notation for methyl 2-[(2-methoxy-2-phenylacetyl)-methylamino]acetate?
The canonical SMILES for methyl 2-[(2-methoxy-2-phenylacetyl)-methylamino]acetate is COC(=O)CN(C)C(=O)C(OC)c1ccccc1.
What is the InChIKey of methyl 2-[(2-methoxy-2-phenylacetyl)-methylamino]acetate?
The InChIKey is FLTKVOPLFZOWDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO4/c1-14(9-11(15)17-2)13(16)12(18-3)10-7-5-4-6-8-10/h4-8,12H,9H2,1-3H3.
What are the key properties of methyl 2-[(2-methoxy-2-phenylacetyl)-methylamino]acetate?
methyl 2-[(2-methoxy-2-phenylacetyl)-methylamino]acetate has a molecular weight of 251.28 g/mol, XLogP of 1.01, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(2-methoxy-2-phenylacetyl)-methylamino]acetate is sourced from PubChem (CID 60777893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).