methyl 6-(2-methoxyethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxylate

C14H16N2O4 — CID 20855188

IUPACmethyl 6-(2-methoxyethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxylate
SMILESCOCCn1ccc2nc(C)c(C(=O)OC)cc2c1=O
InChIInChI=1S/C14H16N2O4/c1-9-10(14(18)20-3)8-11-12(15-9)4-5-16(13(11)17)6-7-19-2/h4-5,8H,6-7H2,1-3H3
InChIKeyICHSJECIPAQQBZ-UHFFFAOYSA-N
MW276.29 g/mol
LogP1.14
Rot. Bonds4

About methyl 6-(2-methoxyethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxylate

methyl 6-(2-methoxyethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxylate (PubChem CID 20855188) has the molecular formula C14H16N2O4 and a molecular weight of 276.29 g/mol. Its IUPAC name is methyl 6-(2-methoxyethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxylate.

Molecular Properties

Compound Namemethyl 6-(2-methoxyethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxylate
PubChem CID20855188
Molecular FormulaC14H16N2O4
Molecular Weight276.29 g/mol
Exact Mass276.11
IUPAC Namemethyl 6-(2-methoxyethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxylate
SMILESCOCCn1ccc2nc(C)c(C(=O)OC)cc2c1=O
InChIInChI=1S/C14H16N2O4/c1-9-10(14(18)20-3)8-11-12(15-9)4-5-16(13(11)17)6-7-19-2/h4-5,8H,6-7H2,1-3H3
InChIKeyICHSJECIPAQQBZ-UHFFFAOYSA-N
XLogP1.14
TPSA70.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 51.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of methyl 6-(2-methoxyethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxylate?
The IUPAC name of methyl 6-(2-methoxyethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxylate (CID 20855188) is methyl 6-(2-methoxyethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxylate.
What is the SMILES notation for methyl 6-(2-methoxyethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxylate?
The canonical SMILES for methyl 6-(2-methoxyethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxylate is COCCn1ccc2nc(C)c(C(=O)OC)cc2c1=O.
What is the InChIKey of methyl 6-(2-methoxyethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxylate?
The InChIKey is ICHSJECIPAQQBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O4/c1-9-10(14(18)20-3)8-11-12(15-9)4-5-16(13(11)17)6-7-19-2/h4-5,8H,6-7H2,1-3H3.
What are the key properties of methyl 6-(2-methoxyethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxylate?
methyl 6-(2-methoxyethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxylate has a molecular weight of 276.29 g/mol, XLogP of 1.14, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 6-(2-methoxyethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxylate is sourced from PubChem (CID 20855188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).