ethyl 2-amino-2-phenylacetate;hydrochloride

C10H14ClNO2 — CID 2781252

IUPACethyl 2-amino-2-phenylacetate;hydrochloride
SMILESCCOC(=O)C(N)c1ccccc1.Cl
InChIInChI=1S/C10H13NO2.ClH/c1-2-13-10(12)9(11)8-6-4-3-5-7-8;/h3-7,9H,2,11H2,1H3;1H
InChIKeyFNNXQLSKQSVNLL-UHFFFAOYSA-N
MW215.68 g/mol
LogP1.67
Rot. Bonds3

About ethyl 2-amino-2-phenylacetate;hydrochloride

ethyl 2-amino-2-phenylacetate;hydrochloride (PubChem CID 2781252) has the molecular formula C10H14ClNO2 and a molecular weight of 215.68 g/mol. Its IUPAC name is ethyl 2-amino-2-phenylacetate;hydrochloride.

Molecular Properties

Compound Nameethyl 2-amino-2-phenylacetate;hydrochloride
PubChem CID2781252
Molecular FormulaC10H14ClNO2
Molecular Weight215.68 g/mol
Exact Mass215.07
IUPAC Nameethyl 2-amino-2-phenylacetate;hydrochloride
SMILESCCOC(=O)C(N)c1ccccc1.Cl
InChIInChI=1S/C10H13NO2.ClH/c1-2-13-10(12)9(11)8-6-4-3-5-7-8;/h3-7,9H,2,11H2,1H3;1H
InChIKeyFNNXQLSKQSVNLL-UHFFFAOYSA-N
XLogP1.67
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.68
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-amino-2-phenylacetate;hydrochloride?
The IUPAC name of ethyl 2-amino-2-phenylacetate;hydrochloride (CID 2781252) is ethyl 2-amino-2-phenylacetate;hydrochloride.
What is the SMILES notation for ethyl 2-amino-2-phenylacetate;hydrochloride?
The canonical SMILES for ethyl 2-amino-2-phenylacetate;hydrochloride is CCOC(=O)C(N)c1ccccc1.Cl.
What is the InChIKey of ethyl 2-amino-2-phenylacetate;hydrochloride?
The InChIKey is FNNXQLSKQSVNLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2.ClH/c1-2-13-10(12)9(11)8-6-4-3-5-7-8;/h3-7,9H,2,11H2,1H3;1H.
What are the key properties of ethyl 2-amino-2-phenylacetate;hydrochloride?
ethyl 2-amino-2-phenylacetate;hydrochloride has a molecular weight of 215.68 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-amino-2-phenylacetate;hydrochloride is sourced from PubChem (CID 2781252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).