ethyl 2-oxo-2-[(6-phenyl-2-pyridinyl)amino]acetate

C15H14N2O3 — CID 110481902

IUPACethyl 2-oxo-2-[(6-phenyl-2-pyridinyl)amino]acetate
SMILESCCOC(=O)C(=O)Nc1cccc(-c2ccccc2)n1
InChIInChI=1S/C15H14N2O3/c1-2-20-15(19)14(18)17-13-10-6-9-12(16-13)11-7-4-3-5-8-11/h3-10H,2H2,1H3,(H,16,17,18)
InChIKeyUVEDJEPOPQLZII-UHFFFAOYSA-N
MW270.29 g/mol
LogP2.25
Rot. Bonds3

About ethyl 2-oxo-2-[(6-phenyl-2-pyridinyl)amino]acetate

ethyl 2-oxo-2-[(6-phenyl-2-pyridinyl)amino]acetate (PubChem CID 110481902) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is ethyl 2-oxo-2-[(6-phenyl-2-pyridinyl)amino]acetate.

Molecular Properties

Compound Nameethyl 2-oxo-2-[(6-phenyl-2-pyridinyl)amino]acetate
PubChem CID110481902
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Nameethyl 2-oxo-2-[(6-phenyl-2-pyridinyl)amino]acetate
SMILESCCOC(=O)C(=O)Nc1cccc(-c2ccccc2)n1
InChIInChI=1S/C15H14N2O3/c1-2-20-15(19)14(18)17-13-10-6-9-12(16-13)11-7-4-3-5-8-11/h3-10H,2H2,1H3,(H,16,17,18)
InChIKeyUVEDJEPOPQLZII-UHFFFAOYSA-N
XLogP2.25
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

2-ethoxyethyl 2-[[6-[[2-(2-ethoxyethoxy)-2-oxoacetyl]amino]-2-pyridinyl]amino]-2-oxoacetate
CID 13277216
4-amino-N-(6-phenyl-2-pyridinyl)butanamide
CID 110479984
N-(6-phenyl-2-pyridinyl)benzamide
CID 24949410
2-amino-3-methyl-N-(6-phenyl-2-pyridinyl)butanamide
CID 110481515
ethyl 2-[2-chloro-3-[(2-ethoxy-2-oxoacetyl)amino]-5-phenylanilino]-2-oxoacetate
CID 21416812
[(6-phenyl-2-pyridinyl)amino]mercury
CID 143075087
2-[(2-methoxyphenyl)methyl]-1-(6-phenyl-2-pyridinyl)guanidine
CID 67532251
ethyl 2-[[4-(3-hydroxyphenyl)-1,3-thiazol-2-yl]amino]-2-oxoacetate
CID 13177556
4-(6-acetamido-2-pyridinyl)benzoic acid
CID 141378052
ethyl N-(6-phenylpyridazin-3-yl)carbamate
CID 59867445
ethyl N-(6-methyl-2-pyridinyl)carbamate
CID 5197559
N-(6-phenyl-2-pyridinyl)thiophene-2-carboxamide
CID 110482191

Frequently Asked Questions

What is the IUPAC name of ethyl 2-oxo-2-[(6-phenyl-2-pyridinyl)amino]acetate?
The IUPAC name of ethyl 2-oxo-2-[(6-phenyl-2-pyridinyl)amino]acetate (CID 110481902) is ethyl 2-oxo-2-[(6-phenyl-2-pyridinyl)amino]acetate.
What is the SMILES notation for ethyl 2-oxo-2-[(6-phenyl-2-pyridinyl)amino]acetate?
The canonical SMILES for ethyl 2-oxo-2-[(6-phenyl-2-pyridinyl)amino]acetate is CCOC(=O)C(=O)Nc1cccc(-c2ccccc2)n1.
What is the InChIKey of ethyl 2-oxo-2-[(6-phenyl-2-pyridinyl)amino]acetate?
The InChIKey is UVEDJEPOPQLZII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-2-20-15(19)14(18)17-13-10-6-9-12(16-13)11-7-4-3-5-8-11/h3-10H,2H2,1H3,(H,16,17,18).
What are the key properties of ethyl 2-oxo-2-[(6-phenyl-2-pyridinyl)amino]acetate?
ethyl 2-oxo-2-[(6-phenyl-2-pyridinyl)amino]acetate has a molecular weight of 270.29 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-oxo-2-[(6-phenyl-2-pyridinyl)amino]acetate is sourced from PubChem (CID 110481902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).