ethyl 2-(2-amino-5-methoxy-3-pyridinyl)acetate

C10H14N2O3 — CID 170599003

IUPACethyl 2-(2-amino-5-methoxy-3-pyridinyl)acetate
SMILESCCOC(=O)Cc1cc(OC)cnc1N
InChIInChI=1S/C10H14N2O3/c1-3-15-9(13)5-7-4-8(14-2)6-12-10(7)11/h4,6H,3,5H2,1-2H3,(H2,11,12)
InChIKeyLUAJFKWHGOVUMP-UHFFFAOYSA-N
MW210.23 g/mol
LogP0.78
Rot. Bonds4

About ethyl 2-(2-amino-5-methoxy-3-pyridinyl)acetate

ethyl 2-(2-amino-5-methoxy-3-pyridinyl)acetate (PubChem CID 170599003) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is ethyl 2-(2-amino-5-methoxy-3-pyridinyl)acetate.

Molecular Properties

Compound Nameethyl 2-(2-amino-5-methoxy-3-pyridinyl)acetate
PubChem CID170599003
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Nameethyl 2-(2-amino-5-methoxy-3-pyridinyl)acetate
SMILESCCOC(=O)Cc1cc(OC)cnc1N
InChIInChI=1S/C10H14N2O3/c1-3-15-9(13)5-7-4-8(14-2)6-12-10(7)11/h4,6H,3,5H2,1-2H3,(H2,11,12)
InChIKeyLUAJFKWHGOVUMP-UHFFFAOYSA-N
XLogP0.78
TPSA74.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 2-[5-methoxy-2-(trifluoromethyl)-3-pyridinyl]acetate
CID 133096845
ethyl 2-(2-amino-5-fluoro-3-pyridinyl)acetate;hydrobromide
CID 66789137
ethyl 2-(3-bromo-2-formyl-5-methoxyphenyl)acetate
CID 171010052
ethyl 2-(5-methoxy-2-methyl-4-pyridinyl)acetate
CID 5314331
methyl 2-[5-methoxy-2-(trifluoromethyl)-3-pyridinyl]acetate
CID 133097191
ethyl 2-(3-bromo-2-cyano-5-methoxyphenyl)acetate
CID 134652638
ethyl 2-[4-amino-6-(difluoromethyl)-5-methoxy-3-pyridinyl]acetate
CID 134683801
ethyl 2-[4-(difluoromethyl)-5-hydroxy-6-methoxy-3-pyridinyl]acetate
CID 133103446
ethyl 2-[5-bromo-6-(difluoromethyl)-4-methoxy-3-pyridinyl]acetate
CID 134684413
ethyl 2-[2-amino-5-(difluoromethyl)-6-methoxy-3-pyridinyl]acetate
CID 134683370
ethyl 2-(5-amino-2-bromo-4-pyridinyl)acetate
CID 133098456
ethyl 2-[4,6-diamino-5-(difluoromethyl)-3-pyridinyl]acetate
CID 134671707

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(2-amino-5-methoxy-3-pyridinyl)acetate?
The IUPAC name of ethyl 2-(2-amino-5-methoxy-3-pyridinyl)acetate (CID 170599003) is ethyl 2-(2-amino-5-methoxy-3-pyridinyl)acetate.
What is the SMILES notation for ethyl 2-(2-amino-5-methoxy-3-pyridinyl)acetate?
The canonical SMILES for ethyl 2-(2-amino-5-methoxy-3-pyridinyl)acetate is CCOC(=O)Cc1cc(OC)cnc1N.
What is the InChIKey of ethyl 2-(2-amino-5-methoxy-3-pyridinyl)acetate?
The InChIKey is LUAJFKWHGOVUMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-3-15-9(13)5-7-4-8(14-2)6-12-10(7)11/h4,6H,3,5H2,1-2H3,(H2,11,12).
What are the key properties of ethyl 2-(2-amino-5-methoxy-3-pyridinyl)acetate?
ethyl 2-(2-amino-5-methoxy-3-pyridinyl)acetate has a molecular weight of 210.23 g/mol, XLogP of 0.78, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(2-amino-5-methoxy-3-pyridinyl)acetate is sourced from PubChem (CID 170599003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).