3,3-bis(phenylmethoxymethyl)azetidine

C19H23NO2 — CID 139666551

IUPAC3,3-bis(phenylmethoxymethyl)azetidine
SMILESc1ccc(COCC2(COCc3ccccc3)CNC2)cc1
InChIInChI=1S/C19H23NO2/c1-3-7-17(8-4-1)11-21-15-19(13-20-14-19)16-22-12-18-9-5-2-6-10-18/h1-10,20H,11-16H2
InChIKeyPCELGRIBEAZWLW-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.01
Rot. Bonds8

About 3,3-bis(phenylmethoxymethyl)azetidine

3,3-bis(phenylmethoxymethyl)azetidine (PubChem CID 139666551) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 3,3-bis(phenylmethoxymethyl)azetidine.

Molecular Properties

Compound Name3,3-bis(phenylmethoxymethyl)azetidine
PubChem CID139666551
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name3,3-bis(phenylmethoxymethyl)azetidine
SMILESc1ccc(COCC2(COCc3ccccc3)CNC2)cc1
InChIInChI=1S/C19H23NO2/c1-3-7-17(8-4-1)11-21-15-19(13-20-14-19)16-22-12-18-9-5-2-6-10-18/h1-10,20H,11-16H2
InChIKeyPCELGRIBEAZWLW-UHFFFAOYSA-N
XLogP3.01
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(phenylmethoxymethyl)cyclopentyl]methanol
CID 83671115
2-[1-(phenylmethoxymethyl)cyclopropyl]ethanamine
CID 65480359
[4,4-dimethoxy-1-(phenylmethoxymethyl)cyclohexyl]methoxymethylbenzene
CID 134289630
[3-(hydroxymethyl)oxetan-3-yl]methanol;[3-(phenylmethoxymethyl)oxetan-3-yl]methanol
CID 159973315
3-methyl-3-(phenylmethoxymethoxy)azetidine
CID 106938741
3-ethyl-3-(phenylmethoxymethyl)oxetane
CID 22066200
2-[1-(phenylmethoxymethyl)cyclopropyl]acetic acid
CID 65496133
5-(bromomethyl)-5-(phenylmethoxymethyl)cycloheptene
CID 165445741
2,2-bis(phenylmethoxymethyl)-1,3-dioxane
CID 59792450
N-methyl-1-[1-(phenylmethoxymethyl)cyclopentyl]methanamine
CID 102940486
CID 66734377
CID 66734377
2-methyl-2-(phenylmethoxymethyl)oxirane
CID 4613554

Frequently Asked Questions

What is the IUPAC name of 3,3-bis(phenylmethoxymethyl)azetidine?
The IUPAC name of 3,3-bis(phenylmethoxymethyl)azetidine (CID 139666551) is 3,3-bis(phenylmethoxymethyl)azetidine.
What is the SMILES notation for 3,3-bis(phenylmethoxymethyl)azetidine?
The canonical SMILES for 3,3-bis(phenylmethoxymethyl)azetidine is c1ccc(COCC2(COCc3ccccc3)CNC2)cc1.
What is the InChIKey of 3,3-bis(phenylmethoxymethyl)azetidine?
The InChIKey is PCELGRIBEAZWLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-3-7-17(8-4-1)11-21-15-19(13-20-14-19)16-22-12-18-9-5-2-6-10-18/h1-10,20H,11-16H2.
What are the key properties of 3,3-bis(phenylmethoxymethyl)azetidine?
3,3-bis(phenylmethoxymethyl)azetidine has a molecular weight of 297.40 g/mol, XLogP of 3.01, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-bis(phenylmethoxymethyl)azetidine is sourced from PubChem (CID 139666551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).