ethyl 2-phenyl-2-pyridin-2-ylacetate

C15H15NO2 — CID 10752615

IUPACethyl 2-phenyl-2-pyridin-2-ylacetate
SMILESCCOC(=O)C(c1ccccc1)c1ccccn1
InChIInChI=1S/C15H15NO2/c1-2-18-15(17)14(12-8-4-3-5-9-12)13-10-6-7-11-16-13/h3-11,14H,2H2,1H3
InChIKeyDCCBOQCYVMNVMX-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.78
Rot. Bonds4

About ethyl 2-phenyl-2-pyridin-2-ylacetate

ethyl 2-phenyl-2-pyridin-2-ylacetate (PubChem CID 10752615) has the molecular formula C15H15NO2 and a molecular weight of 241.29 g/mol. Its IUPAC name is ethyl 2-phenyl-2-pyridin-2-ylacetate.

Molecular Properties

Compound Nameethyl 2-phenyl-2-pyridin-2-ylacetate
PubChem CID10752615
Molecular FormulaC15H15NO2
Molecular Weight241.29 g/mol
Exact Mass241.11
IUPAC Nameethyl 2-phenyl-2-pyridin-2-ylacetate
SMILESCCOC(=O)C(c1ccccc1)c1ccccn1
InChIInChI=1S/C15H15NO2/c1-2-18-15(17)14(12-8-4-3-5-9-12)13-10-6-7-11-16-13/h3-11,14H,2H2,1H3
InChIKeyDCCBOQCYVMNVMX-UHFFFAOYSA-N
XLogP2.78
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl (2S,3R)-2-amino-3-hydroxy-3-pyridin-2-ylpropanoate
CID 124510790
ethyl 2-[[phenyl(pyridin-2-yl)methyl]amino]acetate
CID 60681847
N-ethyl-N,2-diphenyl-2-pyridin-2-ylacetamide
CID 110373393
ethyl N-(dipyridin-2-ylmethyl)carbamate
CID 162768521
ethyl 3-pyridin-2-yl-3-thiophen-3-ylpropanoate
CID 11021653
ethyl 2-amino-2-phenylacetate chloride
CID 3083657
N-tert-butyl-2-phenyl-2-pyridin-2-ylacetamide
CID 110373379
N,2-diphenyl-2-pyridin-2-ylacetamide
CID 110373388
ethyl 2-[hydroxy(pyridin-2-yl)methyl]prop-2-enoate
CID 15812390
(2,2-diphenylacetyl)oxymethyl 2,2-diphenylacetate
CID 15332487
sodium;ethyl 2-hydroxy-2-phenylacetate;hydride
CID 175364908
diethyl 2-(1-ethoxy-2-phenoxy-2-pyridin-2-ylethyl)propanedioate
CID 14652938

Frequently Asked Questions

What is the IUPAC name of ethyl 2-phenyl-2-pyridin-2-ylacetate?
The IUPAC name of ethyl 2-phenyl-2-pyridin-2-ylacetate (CID 10752615) is ethyl 2-phenyl-2-pyridin-2-ylacetate.
What is the SMILES notation for ethyl 2-phenyl-2-pyridin-2-ylacetate?
The canonical SMILES for ethyl 2-phenyl-2-pyridin-2-ylacetate is CCOC(=O)C(c1ccccc1)c1ccccn1.
What is the InChIKey of ethyl 2-phenyl-2-pyridin-2-ylacetate?
The InChIKey is DCCBOQCYVMNVMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2/c1-2-18-15(17)14(12-8-4-3-5-9-12)13-10-6-7-11-16-13/h3-11,14H,2H2,1H3.
What are the key properties of ethyl 2-phenyl-2-pyridin-2-ylacetate?
ethyl 2-phenyl-2-pyridin-2-ylacetate has a molecular weight of 241.29 g/mol, XLogP of 2.78, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-phenyl-2-pyridin-2-ylacetate is sourced from PubChem (CID 10752615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).