methyl 1-[(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)oxy]cyclopropane-1-carboxylate

C14H14N2O5 — CID 168842836

IUPACmethyl 1-[(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)oxy]cyclopropane-1-carboxylate
SMILESCOC(=O)C1(Oc2nc3c(=O)cc[nH]c3cc2OC)CC1
InChIInChI=1S/C14H14N2O5/c1-19-10-7-8-11(9(17)3-6-15-8)16-12(10)21-14(4-5-14)13(18)20-2/h3,6-7H,4-5H2,1-2H3,(H,15,17)
InChIKeyOEZQQZVBZVEBRR-UHFFFAOYSA-N
MW290.27 g/mol
LogP1.02
Rot. Bonds4

About methyl 1-[(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)oxy]cyclopropane-1-carboxylate

methyl 1-[(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)oxy]cyclopropane-1-carboxylate (PubChem CID 168842836) has the molecular formula C14H14N2O5 and a molecular weight of 290.27 g/mol. Its IUPAC name is methyl 1-[(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)oxy]cyclopropane-1-carboxylate.

Molecular Properties

Compound Namemethyl 1-[(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)oxy]cyclopropane-1-carboxylate
PubChem CID168842836
Molecular FormulaC14H14N2O5
Molecular Weight290.27 g/mol
Exact Mass290.09
IUPAC Namemethyl 1-[(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)oxy]cyclopropane-1-carboxylate
SMILESCOC(=O)C1(Oc2nc3c(=O)cc[nH]c3cc2OC)CC1
InChIInChI=1S/C14H14N2O5/c1-19-10-7-8-11(9(17)3-6-15-8)16-12(10)21-14(4-5-14)13(18)20-2/h3,6-7H,4-5H2,1-2H3,(H,15,17)
InChIKeyOEZQQZVBZVEBRR-UHFFFAOYSA-N
XLogP1.02
TPSA90.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.27
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze methyl 1-[(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)oxy]cyclopropane-1-carboxylate with MolForge

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Related Compounds

3-(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)pentane-2,4-dione
CID 167564681
methyl 1-[(5-amino-3-methoxy-2-pyridinyl)oxy]cyclopropane-1-carboxylate
CID 168842871
methyl 1-[(6-methoxy-4-oxo-1H-quinolin-7-yl)oxymethyl]cyclopropane-1-carboxylate
CID 67265186
5-methoxy-3,7-dihydro-2H-[1,4]dioxino[2,3-f]quinolin-10-one
CID 139391203
methyl 5-amino-6-(1-methoxycarbonylcyclopropyl)oxypyridine-3-carboxylate
CID 167003451
8-oxo-5H-1,5-naphthyridine-2-carboxylic acid
CID 132537351
methyl 1-(4-bromo-2,6-difluorophenoxy)cyclopropane-1-carboxylate
CID 90299118
methyl 1-[2-chloro-6-(4-fluorophenyl)pyrimidin-4-yl]oxycyclopropane-1-carboxylate
CID 58134367
3-hydroxy-2-methoxy-1H-pyridin-4-one
CID 45079798
5,6-dimethoxy-1H-pyrrolo[2,3-b]pyridine
CID 74891232
methyl 1-(4-formylphenoxy)cyclopropane-1-carboxylate
CID 97034337
1-(5-methoxy-1H-indol-6-yl)cyclohexane-1-carboxylic acid
CID 117435910

Frequently Asked Questions

What is the IUPAC name of methyl 1-[(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)oxy]cyclopropane-1-carboxylate?
The IUPAC name of methyl 1-[(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)oxy]cyclopropane-1-carboxylate (CID 168842836) is methyl 1-[(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)oxy]cyclopropane-1-carboxylate.
What is the SMILES notation for methyl 1-[(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)oxy]cyclopropane-1-carboxylate?
The canonical SMILES for methyl 1-[(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)oxy]cyclopropane-1-carboxylate is COC(=O)C1(Oc2nc3c(=O)cc[nH]c3cc2OC)CC1.
What is the InChIKey of methyl 1-[(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)oxy]cyclopropane-1-carboxylate?
The InChIKey is OEZQQZVBZVEBRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O5/c1-19-10-7-8-11(9(17)3-6-15-8)16-12(10)21-14(4-5-14)13(18)20-2/h3,6-7H,4-5H2,1-2H3,(H,15,17).
What are the key properties of methyl 1-[(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)oxy]cyclopropane-1-carboxylate?
methyl 1-[(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)oxy]cyclopropane-1-carboxylate has a molecular weight of 290.27 g/mol, XLogP of 1.02, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 1-[(3-methoxy-8-oxo-5H-1,5-naphthyridin-2-yl)oxy]cyclopropane-1-carboxylate is sourced from PubChem (CID 168842836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).