2-[(2-phenylacetyl)amino]acetate

C10H10NO3- — CID 4229702

IUPAC2-[(2-phenylacetyl)amino]acetate
SMILESO=C([O-])CNC(=O)Cc1ccccc1
InChIInChI=1S/C10H11NO3/c12-9(11-7-10(13)14)6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)(H,13,14)/p-1
InChIKeyUTYVDVLMYQPLQB-UHFFFAOYSA-M
MW192.19 g/mol
LogP-0.90
Rot. Bonds4

About 2-[(2-phenylacetyl)amino]acetate

2-[(2-phenylacetyl)amino]acetate (PubChem CID 4229702) has the molecular formula C10H10NO3- and a molecular weight of 192.19 g/mol. Its IUPAC name is 2-[(2-phenylacetyl)amino]acetate.

Molecular Properties

Compound Name2-[(2-phenylacetyl)amino]acetate
PubChem CID4229702
Molecular FormulaC10H10NO3-
Molecular Weight192.19 g/mol
Exact Mass192.07
IUPAC Name2-[(2-phenylacetyl)amino]acetate
SMILESO=C([O-])CNC(=O)Cc1ccccc1
InChIInChI=1S/C10H11NO3/c12-9(11-7-10(13)14)6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)(H,13,14)/p-1
InChIKeyUTYVDVLMYQPLQB-UHFFFAOYSA-M
XLogP-0.90
TPSA69.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.19
LogP ≤ 5-0.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-phenylacetyl)amino]acetate?
The IUPAC name of 2-[(2-phenylacetyl)amino]acetate (CID 4229702) is 2-[(2-phenylacetyl)amino]acetate.
What is the SMILES notation for 2-[(2-phenylacetyl)amino]acetate?
The canonical SMILES for 2-[(2-phenylacetyl)amino]acetate is O=C([O-])CNC(=O)Cc1ccccc1.
What is the InChIKey of 2-[(2-phenylacetyl)amino]acetate?
The InChIKey is UTYVDVLMYQPLQB-UHFFFAOYSA-M. The full InChI is InChI=1S/C10H11NO3/c12-9(11-7-10(13)14)6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)(H,13,14)/p-1.
What are the key properties of 2-[(2-phenylacetyl)amino]acetate?
2-[(2-phenylacetyl)amino]acetate has a molecular weight of 192.19 g/mol, XLogP of -0.90, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-phenylacetyl)amino]acetate is sourced from PubChem (CID 4229702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).