ethyl 2-amino-2,2-diphenylacetate

C16H17NO2 — CID 3925429

IUPACethyl 2-amino-2,2-diphenylacetate
SMILESCCOC(=O)C(N)(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H17NO2/c1-2-19-15(18)16(17,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,2,17H2,1H3
InChIKeyKGGXOKUIZXYLML-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.45
Rot. Bonds4

About ethyl 2-amino-2,2-diphenylacetate

ethyl 2-amino-2,2-diphenylacetate (PubChem CID 3925429) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is ethyl 2-amino-2,2-diphenylacetate.

Molecular Properties

Compound Nameethyl 2-amino-2,2-diphenylacetate
PubChem CID3925429
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Nameethyl 2-amino-2,2-diphenylacetate
SMILESCCOC(=O)C(N)(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H17NO2/c1-2-19-15(18)16(17,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,2,17H2,1H3
InChIKeyKGGXOKUIZXYLML-UHFFFAOYSA-N
XLogP2.45
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze ethyl 2-amino-2,2-diphenylacetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethyl 2-amino-2,2-diphenylacetate?
The IUPAC name of ethyl 2-amino-2,2-diphenylacetate (CID 3925429) is ethyl 2-amino-2,2-diphenylacetate.
What is the SMILES notation for ethyl 2-amino-2,2-diphenylacetate?
The canonical SMILES for ethyl 2-amino-2,2-diphenylacetate is CCOC(=O)C(N)(c1ccccc1)c1ccccc1.
What is the InChIKey of ethyl 2-amino-2,2-diphenylacetate?
The InChIKey is KGGXOKUIZXYLML-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-2-19-15(18)16(17,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,2,17H2,1H3.
What are the key properties of ethyl 2-amino-2,2-diphenylacetate?
ethyl 2-amino-2,2-diphenylacetate has a molecular weight of 255.32 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-amino-2,2-diphenylacetate is sourced from PubChem (CID 3925429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).