2-[[(2R)-2-amino-2-phenylacetyl]-(2-methoxyethyl)amino]acetic acid

C13H18N2O4 — CID 79272062

IUPAC2-[[(2R)-2-amino-2-phenylacetyl]-(2-methoxyethyl)amino]acetic acid
SMILESCOCCN(CC(=O)O)C(=O)[C@H](N)c1ccccc1
InChIInChI=1S/C13H18N2O4/c1-19-8-7-15(9-11(16)17)13(18)12(14)10-5-3-2-4-6-10/h2-6,12H,7-9,14H2,1H3,(H,16,17)/t12-/m1/s1
InChIKeyQSWYEHSFVWZWJV-GFCCVEGCSA-N
MW266.30 g/mol
LogP0.25
Rot. Bonds7

About 2-[[(2R)-2-amino-2-phenylacetyl]-(2-methoxyethyl)amino]acetic acid

2-[[(2R)-2-amino-2-phenylacetyl]-(2-methoxyethyl)amino]acetic acid (PubChem CID 79272062) has the molecular formula C13H18N2O4 and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-[[(2R)-2-amino-2-phenylacetyl]-(2-methoxyethyl)amino]acetic acid.

Molecular Properties

Compound Name2-[[(2R)-2-amino-2-phenylacetyl]-(2-methoxyethyl)amino]acetic acid
PubChem CID79272062
Molecular FormulaC13H18N2O4
Molecular Weight266.30 g/mol
Exact Mass266.13
IUPAC Name2-[[(2R)-2-amino-2-phenylacetyl]-(2-methoxyethyl)amino]acetic acid
SMILESCOCCN(CC(=O)O)C(=O)[C@H](N)c1ccccc1
InChIInChI=1S/C13H18N2O4/c1-19-8-7-15(9-11(16)17)13(18)12(14)10-5-3-2-4-6-10/h2-6,12H,7-9,14H2,1H3,(H,16,17)/t12-/m1/s1
InChIKeyQSWYEHSFVWZWJV-GFCCVEGCSA-N
XLogP0.25
TPSA92.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-2-phenylacetamide
CID 104897454
(2R)-2-amino-N-ethyl-N-(2-methoxyethyl)-2-phenylacetamide
CID 54949185
2-[(2-amino-3-phenylpropanoyl)-(2-methoxyethyl)amino]acetic acid
CID 79269846
2-amino-N-cyclopropyl-N-(2-methoxyethyl)-2-phenylacetamide
CID 54872258
2-amino-N,N-bis(2-methoxyethyl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120666531
methyl 2-[[(2S)-2-amino-2-phenylacetyl]-propylamino]acetate
CID 93371927
(2R)-2-amino-N-(2-ethoxyethyl)-N-ethyl-2-phenylacetamide
CID 63692706
2-[2-methoxyethyl(3-phenylpent-4-enoyl)amino]acetic acid
CID 120516172
2-[(2-amino-2-phenylacetyl)-prop-2-ynylamino]acetic acid
CID 79273974
2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]-(2-methoxyethyl)amino]acetic acid
CID 79272186
2-[[(2R)-2-amino-3-(4-hydroxyphenyl)propanoyl]-(2-methoxyethyl)amino]acetic acid
CID 103869710
2-[[(2S)-2-amino-2-phenylacetyl]-(cyclopropylmethyl)amino]acetic acid
CID 103869512

Frequently Asked Questions

What is the IUPAC name of 2-[[(2R)-2-amino-2-phenylacetyl]-(2-methoxyethyl)amino]acetic acid?
The IUPAC name of 2-[[(2R)-2-amino-2-phenylacetyl]-(2-methoxyethyl)amino]acetic acid (CID 79272062) is 2-[[(2R)-2-amino-2-phenylacetyl]-(2-methoxyethyl)amino]acetic acid.
What is the SMILES notation for 2-[[(2R)-2-amino-2-phenylacetyl]-(2-methoxyethyl)amino]acetic acid?
The canonical SMILES for 2-[[(2R)-2-amino-2-phenylacetyl]-(2-methoxyethyl)amino]acetic acid is COCCN(CC(=O)O)C(=O)[C@H](N)c1ccccc1.
What is the InChIKey of 2-[[(2R)-2-amino-2-phenylacetyl]-(2-methoxyethyl)amino]acetic acid?
The InChIKey is QSWYEHSFVWZWJV-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H18N2O4/c1-19-8-7-15(9-11(16)17)13(18)12(14)10-5-3-2-4-6-10/h2-6,12H,7-9,14H2,1H3,(H,16,17)/t12-/m1/s1.
What are the key properties of 2-[[(2R)-2-amino-2-phenylacetyl]-(2-methoxyethyl)amino]acetic acid?
2-[[(2R)-2-amino-2-phenylacetyl]-(2-methoxyethyl)amino]acetic acid has a molecular weight of 266.30 g/mol, XLogP of 0.25, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2R)-2-amino-2-phenylacetyl]-(2-methoxyethyl)amino]acetic acid is sourced from PubChem (CID 79272062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).