ethyl 2-amino-2-(5-amino-6-phenyl-2-pyridinyl)acetate

C15H17N3O2 — CID 118393279

IUPACethyl 2-amino-2-(5-amino-6-phenyl-2-pyridinyl)acetate
SMILESCCOC(=O)C(N)c1ccc(N)c(-c2ccccc2)n1
InChIInChI=1S/C15H17N3O2/c1-2-20-15(19)13(17)12-9-8-11(16)14(18-12)10-6-4-3-5-7-10/h3-9,13H,2,16-17H2,1H3
InChIKeyFUCFREYULOQLLJ-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.89
Rot. Bonds4

About ethyl 2-amino-2-(5-amino-6-phenyl-2-pyridinyl)acetate

ethyl 2-amino-2-(5-amino-6-phenyl-2-pyridinyl)acetate (PubChem CID 118393279) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is ethyl 2-amino-2-(5-amino-6-phenyl-2-pyridinyl)acetate.

Molecular Properties

Compound Nameethyl 2-amino-2-(5-amino-6-phenyl-2-pyridinyl)acetate
PubChem CID118393279
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Nameethyl 2-amino-2-(5-amino-6-phenyl-2-pyridinyl)acetate
SMILESCCOC(=O)C(N)c1ccc(N)c(-c2ccccc2)n1
InChIInChI=1S/C15H17N3O2/c1-2-20-15(19)13(17)12-9-8-11(16)14(18-12)10-6-4-3-5-7-10/h3-9,13H,2,16-17H2,1H3
InChIKeyFUCFREYULOQLLJ-UHFFFAOYSA-N
XLogP1.89
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 2-amino-2-(6-methyl-2-pyridinyl)acetate
CID 3937325
ethyl 2-amino-2-[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-phenyl-2-pyridinyl]acetate
CID 140861912
ethyl (2R)-2-amino-2-phenylacetate
CID 6922658
ethyl 2-amino-2-phenylacetate chloride
CID 3083657
ethyl 2-amino-2-pyridazin-3-ylacetate
CID 22062849
ethyl 2-amino-3-(5-methyl-3-phenyl-1,2-oxazol-4-yl)propanoate
CID 170884921
3-ethoxy-2-[(5-methyl-4-phenylpyrimidin-2-yl)methyl]-3-oxopropanoic acid
CID 129064950
ethyl (2R)-2-[(2R)-2-methyl-5-phenyl-3H-1,3,4-thiadiazol-2-yl]butanoate
CID 126091650
ethyl 2-(4,5-diphenyl-1,3-oxazol-2-yl)acetate
CID 14971801
ethyl 2-amino-6-phenylpyridine-3-carboxylate
CID 1236695
ethyl 4-methyl-6-phenylpyrimidine-5-carboxylate
CID 135045794
ethyl 2-(4,5-diphenyltriazol-2-yl)acetate
CID 59363121

Frequently Asked Questions

What is the IUPAC name of ethyl 2-amino-2-(5-amino-6-phenyl-2-pyridinyl)acetate?
The IUPAC name of ethyl 2-amino-2-(5-amino-6-phenyl-2-pyridinyl)acetate (CID 118393279) is ethyl 2-amino-2-(5-amino-6-phenyl-2-pyridinyl)acetate.
What is the SMILES notation for ethyl 2-amino-2-(5-amino-6-phenyl-2-pyridinyl)acetate?
The canonical SMILES for ethyl 2-amino-2-(5-amino-6-phenyl-2-pyridinyl)acetate is CCOC(=O)C(N)c1ccc(N)c(-c2ccccc2)n1.
What is the InChIKey of ethyl 2-amino-2-(5-amino-6-phenyl-2-pyridinyl)acetate?
The InChIKey is FUCFREYULOQLLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-2-20-15(19)13(17)12-9-8-11(16)14(18-12)10-6-4-3-5-7-10/h3-9,13H,2,16-17H2,1H3.
What are the key properties of ethyl 2-amino-2-(5-amino-6-phenyl-2-pyridinyl)acetate?
ethyl 2-amino-2-(5-amino-6-phenyl-2-pyridinyl)acetate has a molecular weight of 271.32 g/mol, XLogP of 1.89, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-amino-2-(5-amino-6-phenyl-2-pyridinyl)acetate is sourced from PubChem (CID 118393279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).