6-methyl-3-(oxetan-3-yl)-7,8-dihydro-5H-1,6-naphthyridine

C12H16N2O — CID 155579851

IUPAC6-methyl-3-(oxetan-3-yl)-7,8-dihydro-5H-1,6-naphthyridine
SMILESCN1CCc2ncc(C3COC3)cc2C1
InChIInChI=1S/C12H16N2O/c1-14-3-2-12-10(6-14)4-9(5-13-12)11-7-15-8-11/h4-5,11H,2-3,6-8H2,1H3
InChIKeyHWLNDJZMOJRPSD-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.18
Rot. Bonds1

About 6-methyl-3-(oxetan-3-yl)-7,8-dihydro-5H-1,6-naphthyridine

6-methyl-3-(oxetan-3-yl)-7,8-dihydro-5H-1,6-naphthyridine (PubChem CID 155579851) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 6-methyl-3-(oxetan-3-yl)-7,8-dihydro-5H-1,6-naphthyridine.

Molecular Properties

Compound Name6-methyl-3-(oxetan-3-yl)-7,8-dihydro-5H-1,6-naphthyridine
PubChem CID155579851
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name6-methyl-3-(oxetan-3-yl)-7,8-dihydro-5H-1,6-naphthyridine
SMILESCN1CCc2ncc(C3COC3)cc2C1
InChIInChI=1S/C12H16N2O/c1-14-3-2-12-10(6-14)4-9(5-13-12)11-7-15-8-11/h4-5,11H,2-3,6-8H2,1H3
InChIKeyHWLNDJZMOJRPSD-UHFFFAOYSA-N
XLogP1.18
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-(oxetan-3-yl)-7,8-dihydro-5H-1,6-naphthyridine?
The IUPAC name of 6-methyl-3-(oxetan-3-yl)-7,8-dihydro-5H-1,6-naphthyridine (CID 155579851) is 6-methyl-3-(oxetan-3-yl)-7,8-dihydro-5H-1,6-naphthyridine.
What is the SMILES notation for 6-methyl-3-(oxetan-3-yl)-7,8-dihydro-5H-1,6-naphthyridine?
The canonical SMILES for 6-methyl-3-(oxetan-3-yl)-7,8-dihydro-5H-1,6-naphthyridine is CN1CCc2ncc(C3COC3)cc2C1.
What is the InChIKey of 6-methyl-3-(oxetan-3-yl)-7,8-dihydro-5H-1,6-naphthyridine?
The InChIKey is HWLNDJZMOJRPSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-14-3-2-12-10(6-14)4-9(5-13-12)11-7-15-8-11/h4-5,11H,2-3,6-8H2,1H3.
What are the key properties of 6-methyl-3-(oxetan-3-yl)-7,8-dihydro-5H-1,6-naphthyridine?
6-methyl-3-(oxetan-3-yl)-7,8-dihydro-5H-1,6-naphthyridine has a molecular weight of 204.27 g/mol, XLogP of 1.18, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-(oxetan-3-yl)-7,8-dihydro-5H-1,6-naphthyridine is sourced from PubChem (CID 155579851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).