3-(2-methoxynaphthalen-1-yl)oxyazetidine

C14H15NO2 — CID 15390703

IUPAC3-(2-methoxynaphthalen-1-yl)oxyazetidine
SMILESCOc1ccc2ccccc2c1OC1CNC1
InChIInChI=1S/C14H15NO2/c1-16-13-7-6-10-4-2-3-5-12(10)14(13)17-11-8-15-9-11/h2-7,11,15H,8-9H2,1H3
InChIKeyLTACBDSKGDSLEO-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.20
Rot. Bonds3

About 3-(2-methoxynaphthalen-1-yl)oxyazetidine

3-(2-methoxynaphthalen-1-yl)oxyazetidine (PubChem CID 15390703) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is 3-(2-methoxynaphthalen-1-yl)oxyazetidine.

Molecular Properties

Compound Name3-(2-methoxynaphthalen-1-yl)oxyazetidine
PubChem CID15390703
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Name3-(2-methoxynaphthalen-1-yl)oxyazetidine
SMILESCOc1ccc2ccccc2c1OC1CNC1
InChIInChI=1S/C14H15NO2/c1-16-13-7-6-10-4-2-3-5-12(10)14(13)17-11-8-15-9-11/h2-7,11,15H,8-9H2,1H3
InChIKeyLTACBDSKGDSLEO-UHFFFAOYSA-N
XLogP2.20
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxynaphthalen-1-yl)oxyazetidine?
The IUPAC name of 3-(2-methoxynaphthalen-1-yl)oxyazetidine (CID 15390703) is 3-(2-methoxynaphthalen-1-yl)oxyazetidine.
What is the SMILES notation for 3-(2-methoxynaphthalen-1-yl)oxyazetidine?
The canonical SMILES for 3-(2-methoxynaphthalen-1-yl)oxyazetidine is COc1ccc2ccccc2c1OC1CNC1.
What is the InChIKey of 3-(2-methoxynaphthalen-1-yl)oxyazetidine?
The InChIKey is LTACBDSKGDSLEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c1-16-13-7-6-10-4-2-3-5-12(10)14(13)17-11-8-15-9-11/h2-7,11,15H,8-9H2,1H3.
What are the key properties of 3-(2-methoxynaphthalen-1-yl)oxyazetidine?
3-(2-methoxynaphthalen-1-yl)oxyazetidine has a molecular weight of 229.28 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxynaphthalen-1-yl)oxyazetidine is sourced from PubChem (CID 15390703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).