ethyl 2-oxo-1H-1,8-naphthyridine-4-carboxylate

C11H10N2O3 — CID 76849396

IUPACethyl 2-oxo-1H-1,8-naphthyridine-4-carboxylate
SMILESCCOC(=O)c1cc(=O)[nH]c2ncccc12
InChIInChI=1S/C11H10N2O3/c1-2-16-11(15)8-6-9(14)13-10-7(8)4-3-5-12-10/h3-6H,2H2,1H3,(H,12,13,14)
InChIKeyCHICYFCZUXUBBZ-UHFFFAOYSA-N
MW218.21 g/mol
LogP1.10
Rot. Bonds2

About ethyl 2-oxo-1H-1,8-naphthyridine-4-carboxylate

ethyl 2-oxo-1H-1,8-naphthyridine-4-carboxylate (PubChem CID 76849396) has the molecular formula C11H10N2O3 and a molecular weight of 218.21 g/mol. Its IUPAC name is ethyl 2-oxo-1H-1,8-naphthyridine-4-carboxylate.

Molecular Properties

Compound Nameethyl 2-oxo-1H-1,8-naphthyridine-4-carboxylate
PubChem CID76849396
Molecular FormulaC11H10N2O3
Molecular Weight218.21 g/mol
Exact Mass218.07
IUPAC Nameethyl 2-oxo-1H-1,8-naphthyridine-4-carboxylate
SMILESCCOC(=O)c1cc(=O)[nH]c2ncccc12
InChIInChI=1S/C11H10N2O3/c1-2-16-11(15)8-6-9(14)13-10-7(8)4-3-5-12-10/h3-6H,2H2,1H3,(H,12,13,14)
InChIKeyCHICYFCZUXUBBZ-UHFFFAOYSA-N
XLogP1.10
TPSA72.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 9H-pyrido[2,3-b]indole-8-carboxylate
CID 135002978
ethyl 2-oxo-1H-1,8-naphthyridine-3-carboxylate
CID 11564777
ethyl 8-chloro-2-oxo-1H-quinoline-4-carboxylate
CID 4772724
ethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate
CID 135059817
ethyl 7-fluoro-2-oxo-1H-quinoline-4-carboxylate
CID 162422252
ethyl 4-(2-chlorophenyl)-2-oxo-1H-1,8-naphthyridine-3-carboxylate
CID 22105943
[2-(4-ethoxycarbonylanilino)-2-oxoethyl] 2-oxo-1H-quinoline-4-carboxylate
CID 2489819
ethyl 2-hydrazinylpyridine-3-carboxylate;hydrochloride
CID 146675652
2-(3-methylphenoxy)ethyl 2-oxo-1H-quinoline-4-carboxylate
CID 2431953
ethyl 6-hydroxyquinoline-7-carboxylate
CID 133084141
ethyl 5-hydroxy-8-oxo-7H-1,7-naphthyridine-6-carboxylate
CID 54696338
ethyl 4-morpholin-4-yl-2-oxo-1H-1,8-naphthyridine-3-carboxylate
CID 70596773

Frequently Asked Questions

What is the IUPAC name of ethyl 2-oxo-1H-1,8-naphthyridine-4-carboxylate?
The IUPAC name of ethyl 2-oxo-1H-1,8-naphthyridine-4-carboxylate (CID 76849396) is ethyl 2-oxo-1H-1,8-naphthyridine-4-carboxylate.
What is the SMILES notation for ethyl 2-oxo-1H-1,8-naphthyridine-4-carboxylate?
The canonical SMILES for ethyl 2-oxo-1H-1,8-naphthyridine-4-carboxylate is CCOC(=O)c1cc(=O)[nH]c2ncccc12.
What is the InChIKey of ethyl 2-oxo-1H-1,8-naphthyridine-4-carboxylate?
The InChIKey is CHICYFCZUXUBBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O3/c1-2-16-11(15)8-6-9(14)13-10-7(8)4-3-5-12-10/h3-6H,2H2,1H3,(H,12,13,14).
What are the key properties of ethyl 2-oxo-1H-1,8-naphthyridine-4-carboxylate?
ethyl 2-oxo-1H-1,8-naphthyridine-4-carboxylate has a molecular weight of 218.21 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-oxo-1H-1,8-naphthyridine-4-carboxylate is sourced from PubChem (CID 76849396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).