2-(2-phenylmethoxyphenyl)azetidine

C16H17NO — CID 130043680

IUPAC2-(2-phenylmethoxyphenyl)azetidine
SMILESc1ccc(COc2ccccc2C2CCN2)cc1
InChIInChI=1S/C16H17NO/c1-2-6-13(7-3-1)12-18-16-9-5-4-8-14(16)15-10-11-17-15/h1-9,15,17H,10-12H2
InChIKeyFAPDDLPXNUTDCW-UHFFFAOYSA-N
MW239.32 g/mol
LogP3.30
Rot. Bonds4

About 2-(2-phenylmethoxyphenyl)azetidine

2-(2-phenylmethoxyphenyl)azetidine (PubChem CID 130043680) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is 2-(2-phenylmethoxyphenyl)azetidine.

Molecular Properties

Compound Name2-(2-phenylmethoxyphenyl)azetidine
PubChem CID130043680
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC Name2-(2-phenylmethoxyphenyl)azetidine
SMILESc1ccc(COc2ccccc2C2CCN2)cc1
InChIInChI=1S/C16H17NO/c1-2-6-13(7-3-1)12-18-16-9-5-4-8-14(16)15-10-11-17-15/h1-9,15,17H,10-12H2
InChIKeyFAPDDLPXNUTDCW-UHFFFAOYSA-N
XLogP3.30
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylmethoxyphenyl)azetidine?
The IUPAC name of 2-(2-phenylmethoxyphenyl)azetidine (CID 130043680) is 2-(2-phenylmethoxyphenyl)azetidine.
What is the SMILES notation for 2-(2-phenylmethoxyphenyl)azetidine?
The canonical SMILES for 2-(2-phenylmethoxyphenyl)azetidine is c1ccc(COc2ccccc2C2CCN2)cc1.
What is the InChIKey of 2-(2-phenylmethoxyphenyl)azetidine?
The InChIKey is FAPDDLPXNUTDCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO/c1-2-6-13(7-3-1)12-18-16-9-5-4-8-14(16)15-10-11-17-15/h1-9,15,17H,10-12H2.
What are the key properties of 2-(2-phenylmethoxyphenyl)azetidine?
2-(2-phenylmethoxyphenyl)azetidine has a molecular weight of 239.32 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylmethoxyphenyl)azetidine is sourced from PubChem (CID 130043680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).