ethyl 6-amino-5-hydroxypyridine-2-carboxylate

C8H10N2O3 — CID 126988656

IUPACethyl 6-amino-5-hydroxypyridine-2-carboxylate
SMILESCCOC(=O)c1ccc(O)c(N)n1
InChIInChI=1S/C8H10N2O3/c1-2-13-8(12)5-3-4-6(11)7(9)10-5/h3-4,11H,2H2,1H3,(H2,9,10)
InChIKeyDKWZKQUQDUTMPH-UHFFFAOYSA-N
MW182.18 g/mol
LogP0.55
Rot. Bonds2

About ethyl 6-amino-5-hydroxypyridine-2-carboxylate

ethyl 6-amino-5-hydroxypyridine-2-carboxylate (PubChem CID 126988656) has the molecular formula C8H10N2O3 and a molecular weight of 182.18 g/mol. Its IUPAC name is ethyl 6-amino-5-hydroxypyridine-2-carboxylate.

Molecular Properties

Compound Nameethyl 6-amino-5-hydroxypyridine-2-carboxylate
PubChem CID126988656
Molecular FormulaC8H10N2O3
Molecular Weight182.18 g/mol
Exact Mass182.07
IUPAC Nameethyl 6-amino-5-hydroxypyridine-2-carboxylate
SMILESCCOC(=O)c1ccc(O)c(N)n1
InChIInChI=1S/C8H10N2O3/c1-2-13-8(12)5-3-4-6(11)7(9)10-5/h3-4,11H,2H2,1H3,(H2,9,10)
InChIKeyDKWZKQUQDUTMPH-UHFFFAOYSA-N
XLogP0.55
TPSA85.44 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 6-amino-5-chloropyridine-2-carboxylate
CID 138112595
ethyl 6-bromo-5-hydroxypyridine-2-carboxylate
CID 117272848
ethyl 5-hydroxy-6-(trifluoromethyl)pyridine-2-carboxylate
CID 133096834
ethyl 6-(difluoromethyl)-5-hydroxypyridine-2-carboxylate
CID 133093182
ethyl 6-methyl-5-(2-methylprop-1-enyl)pyridine-2-carboxylate
CID 67026997
ethyl 6-bromo-5-chloropyridine-2-carboxylate
CID 46311447
ethyl 6-chloro-5-fluoropyridine-2-carboxylate
CID 46311494
diethyl 4-aminopyridine-2,6-dicarboxylate;hydrochloride
CID 137333254
ethyl 5-amino-6-(trifluoromethoxy)pyridine-2-carboxylate
CID 171028937
ethyl 6-bromopyridine-2-carboxylate
CID 2758810
diethyl 3,6-diaminopyrazine-2,5-dicarboxylate
CID 15404198
ethyl 6,8-dimethylquinoline-2-carboxylate
CID 102310352

Frequently Asked Questions

What is the IUPAC name of ethyl 6-amino-5-hydroxypyridine-2-carboxylate?
The IUPAC name of ethyl 6-amino-5-hydroxypyridine-2-carboxylate (CID 126988656) is ethyl 6-amino-5-hydroxypyridine-2-carboxylate.
What is the SMILES notation for ethyl 6-amino-5-hydroxypyridine-2-carboxylate?
The canonical SMILES for ethyl 6-amino-5-hydroxypyridine-2-carboxylate is CCOC(=O)c1ccc(O)c(N)n1.
What is the InChIKey of ethyl 6-amino-5-hydroxypyridine-2-carboxylate?
The InChIKey is DKWZKQUQDUTMPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O3/c1-2-13-8(12)5-3-4-6(11)7(9)10-5/h3-4,11H,2H2,1H3,(H2,9,10).
What are the key properties of ethyl 6-amino-5-hydroxypyridine-2-carboxylate?
ethyl 6-amino-5-hydroxypyridine-2-carboxylate has a molecular weight of 182.18 g/mol, XLogP of 0.55, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 6-amino-5-hydroxypyridine-2-carboxylate is sourced from PubChem (CID 126988656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).