2-(2-methoxyethoxy)-5,6,7,8-tetrahydro-1,6-naphthyridine

C11H16N2O2 — CID 86820430

IUPAC2-(2-methoxyethoxy)-5,6,7,8-tetrahydro-1,6-naphthyridine
SMILESCOCCOc1ccc2c(n1)CCNC2
InChIInChI=1S/C11H16N2O2/c1-14-6-7-15-11-3-2-9-8-12-5-4-10(9)13-11/h2-3,12H,4-8H2,1H3
InChIKeyRBQYARIFIKKWIH-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.75
Rot. Bonds4

About 2-(2-methoxyethoxy)-5,6,7,8-tetrahydro-1,6-naphthyridine

2-(2-methoxyethoxy)-5,6,7,8-tetrahydro-1,6-naphthyridine (PubChem CID 86820430) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)-5,6,7,8-tetrahydro-1,6-naphthyridine.

Molecular Properties

Compound Name2-(2-methoxyethoxy)-5,6,7,8-tetrahydro-1,6-naphthyridine
PubChem CID86820430
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name2-(2-methoxyethoxy)-5,6,7,8-tetrahydro-1,6-naphthyridine
SMILESCOCCOc1ccc2c(n1)CCNC2
InChIInChI=1S/C11H16N2O2/c1-14-6-7-15-11-3-2-9-8-12-5-4-10(9)13-11/h2-3,12H,4-8H2,1H3
InChIKeyRBQYARIFIKKWIH-UHFFFAOYSA-N
XLogP0.75
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethoxy)-5,6,7,8-tetrahydro-1,6-naphthyridine?
The IUPAC name of 2-(2-methoxyethoxy)-5,6,7,8-tetrahydro-1,6-naphthyridine (CID 86820430) is 2-(2-methoxyethoxy)-5,6,7,8-tetrahydro-1,6-naphthyridine.
What is the SMILES notation for 2-(2-methoxyethoxy)-5,6,7,8-tetrahydro-1,6-naphthyridine?
The canonical SMILES for 2-(2-methoxyethoxy)-5,6,7,8-tetrahydro-1,6-naphthyridine is COCCOc1ccc2c(n1)CCNC2.
What is the InChIKey of 2-(2-methoxyethoxy)-5,6,7,8-tetrahydro-1,6-naphthyridine?
The InChIKey is RBQYARIFIKKWIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-14-6-7-15-11-3-2-9-8-12-5-4-10(9)13-11/h2-3,12H,4-8H2,1H3.
What are the key properties of 2-(2-methoxyethoxy)-5,6,7,8-tetrahydro-1,6-naphthyridine?
2-(2-methoxyethoxy)-5,6,7,8-tetrahydro-1,6-naphthyridine has a molecular weight of 208.26 g/mol, XLogP of 0.75, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)-5,6,7,8-tetrahydro-1,6-naphthyridine is sourced from PubChem (CID 86820430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).