2-[2-(oxan-4-yl)ethoxy]-1,8-naphthyridine

C15H18N2O2 — CID 167971326

IUPAC2-[2-(oxan-4-yl)ethoxy]-1,8-naphthyridine
SMILESc1cnc2nc(OCCC3CCOCC3)ccc2c1
InChIInChI=1S/C15H18N2O2/c1-2-13-3-4-14(17-15(13)16-8-1)19-11-7-12-5-9-18-10-6-12/h1-4,8,12H,5-7,9-11H2
InChIKeyYQVQREYVOHECSJ-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.83
Rot. Bonds4

About 2-[2-(oxan-4-yl)ethoxy]-1,8-naphthyridine

2-[2-(oxan-4-yl)ethoxy]-1,8-naphthyridine (PubChem CID 167971326) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-[2-(oxan-4-yl)ethoxy]-1,8-naphthyridine.

Molecular Properties

Compound Name2-[2-(oxan-4-yl)ethoxy]-1,8-naphthyridine
PubChem CID167971326
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name2-[2-(oxan-4-yl)ethoxy]-1,8-naphthyridine
SMILESc1cnc2nc(OCCC3CCOCC3)ccc2c1
InChIInChI=1S/C15H18N2O2/c1-2-13-3-4-14(17-15(13)16-8-1)19-11-7-12-5-9-18-10-6-12/h1-4,8,12H,5-7,9-11H2
InChIKeyYQVQREYVOHECSJ-UHFFFAOYSA-N
XLogP2.83
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(oxan-4-yl)ethoxy]-1,8-naphthyridine?
The IUPAC name of 2-[2-(oxan-4-yl)ethoxy]-1,8-naphthyridine (CID 167971326) is 2-[2-(oxan-4-yl)ethoxy]-1,8-naphthyridine.
What is the SMILES notation for 2-[2-(oxan-4-yl)ethoxy]-1,8-naphthyridine?
The canonical SMILES for 2-[2-(oxan-4-yl)ethoxy]-1,8-naphthyridine is c1cnc2nc(OCCC3CCOCC3)ccc2c1.
What is the InChIKey of 2-[2-(oxan-4-yl)ethoxy]-1,8-naphthyridine?
The InChIKey is YQVQREYVOHECSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-2-13-3-4-14(17-15(13)16-8-1)19-11-7-12-5-9-18-10-6-12/h1-4,8,12H,5-7,9-11H2.
What are the key properties of 2-[2-(oxan-4-yl)ethoxy]-1,8-naphthyridine?
2-[2-(oxan-4-yl)ethoxy]-1,8-naphthyridine has a molecular weight of 258.32 g/mol, XLogP of 2.83, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(oxan-4-yl)ethoxy]-1,8-naphthyridine is sourced from PubChem (CID 167971326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).