ethyl 8-methoxy-1,5-naphthyridine-3-carboxylate

C12H12N2O3 — CID 59256763

IUPACethyl 8-methoxy-1,5-naphthyridine-3-carboxylate
SMILESCCOC(=O)c1cnc2c(OC)ccnc2c1
InChIInChI=1S/C12H12N2O3/c1-3-17-12(15)8-6-9-11(14-7-8)10(16-2)4-5-13-9/h4-7H,3H2,1-2H3
InChIKeyLVNSGKXEDHTUFO-UHFFFAOYSA-N
MW232.24 g/mol
LogP1.82
Rot. Bonds3

About ethyl 8-methoxy-1,5-naphthyridine-3-carboxylate

ethyl 8-methoxy-1,5-naphthyridine-3-carboxylate (PubChem CID 59256763) has the molecular formula C12H12N2O3 and a molecular weight of 232.24 g/mol. Its IUPAC name is ethyl 8-methoxy-1,5-naphthyridine-3-carboxylate.

Molecular Properties

Compound Nameethyl 8-methoxy-1,5-naphthyridine-3-carboxylate
PubChem CID59256763
Molecular FormulaC12H12N2O3
Molecular Weight232.24 g/mol
Exact Mass232.08
IUPAC Nameethyl 8-methoxy-1,5-naphthyridine-3-carboxylate
SMILESCCOC(=O)c1cnc2c(OC)ccnc2c1
InChIInChI=1S/C12H12N2O3/c1-3-17-12(15)8-6-9-11(14-7-8)10(16-2)4-5-13-9/h4-7H,3H2,1-2H3
InChIKeyLVNSGKXEDHTUFO-UHFFFAOYSA-N
XLogP1.82
TPSA61.31 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 4-ethoxyquinoline-7-carboxylate
CID 91667888
5-ethoxycarbonyl-3-methoxypyridine-2-carboxylic acid
CID 22923766
ethyl 8-ethoxyquinoline-3-carboxylate
CID 122362443
ethyl 6-fluoro-7-methoxyquinoline-3-carboxylate
CID 129247905
ethyl 3-amino-8-methoxyquinoline-6-carboxylate
CID 156872720
3-chloro-8-methoxy-1,5-naphthyridine
CID 155294269
ethyl 2-bromo-4-methoxypyridine-3-carboxylate
CID 90167118
ethyl 7-methoxyquinoline-3-carboxylate;hydrochloride
CID 22326874
ethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate
CID 135059817
ethyl 2-(4-chloro-3,5-dimethoxyphenyl)pyridine-4-carboxylate
CID 22557799
ethyl 4-bromo-7-methoxyquinoline-6-carboxylate
CID 122705966
ethyl 5-methoxyisoquinoline-3-carboxylate
CID 131699571

Frequently Asked Questions

What is the IUPAC name of ethyl 8-methoxy-1,5-naphthyridine-3-carboxylate?
The IUPAC name of ethyl 8-methoxy-1,5-naphthyridine-3-carboxylate (CID 59256763) is ethyl 8-methoxy-1,5-naphthyridine-3-carboxylate.
What is the SMILES notation for ethyl 8-methoxy-1,5-naphthyridine-3-carboxylate?
The canonical SMILES for ethyl 8-methoxy-1,5-naphthyridine-3-carboxylate is CCOC(=O)c1cnc2c(OC)ccnc2c1.
What is the InChIKey of ethyl 8-methoxy-1,5-naphthyridine-3-carboxylate?
The InChIKey is LVNSGKXEDHTUFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O3/c1-3-17-12(15)8-6-9-11(14-7-8)10(16-2)4-5-13-9/h4-7H,3H2,1-2H3.
What are the key properties of ethyl 8-methoxy-1,5-naphthyridine-3-carboxylate?
ethyl 8-methoxy-1,5-naphthyridine-3-carboxylate has a molecular weight of 232.24 g/mol, XLogP of 1.82, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 8-methoxy-1,5-naphthyridine-3-carboxylate is sourced from PubChem (CID 59256763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).