2-(azetidin-3-ylmethyl)-5-(2-methoxyphenyl)-1,3-oxazole

C14H16N2O2 — CID 115045283

IUPAC2-(azetidin-3-ylmethyl)-5-(2-methoxyphenyl)-1,3-oxazole
SMILESCOc1ccccc1-c1cnc(CC2CNC2)o1
InChIInChI=1S/C14H16N2O2/c1-17-12-5-3-2-4-11(12)13-9-16-14(18-13)6-10-7-15-8-10/h2-5,9-10,15H,6-8H2,1H3
InChIKeyWHYNWSNIABULDG-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.11
Rot. Bonds4

About 2-(azetidin-3-ylmethyl)-5-(2-methoxyphenyl)-1,3-oxazole

2-(azetidin-3-ylmethyl)-5-(2-methoxyphenyl)-1,3-oxazole (PubChem CID 115045283) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 2-(azetidin-3-ylmethyl)-5-(2-methoxyphenyl)-1,3-oxazole.

Molecular Properties

Compound Name2-(azetidin-3-ylmethyl)-5-(2-methoxyphenyl)-1,3-oxazole
PubChem CID115045283
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name2-(azetidin-3-ylmethyl)-5-(2-methoxyphenyl)-1,3-oxazole
SMILESCOc1ccccc1-c1cnc(CC2CNC2)o1
InChIInChI=1S/C14H16N2O2/c1-17-12-5-3-2-4-11(12)13-9-16-14(18-13)6-10-7-15-8-10/h2-5,9-10,15H,6-8H2,1H3
InChIKeyWHYNWSNIABULDG-UHFFFAOYSA-N
XLogP2.11
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(azetidin-3-ylmethyl)-5-(2-methoxyphenyl)-1,3-oxazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-ylmethyl)-5-(2-methoxyphenyl)-1,3-oxazole?
The IUPAC name of 2-(azetidin-3-ylmethyl)-5-(2-methoxyphenyl)-1,3-oxazole (CID 115045283) is 2-(azetidin-3-ylmethyl)-5-(2-methoxyphenyl)-1,3-oxazole.
What is the SMILES notation for 2-(azetidin-3-ylmethyl)-5-(2-methoxyphenyl)-1,3-oxazole?
The canonical SMILES for 2-(azetidin-3-ylmethyl)-5-(2-methoxyphenyl)-1,3-oxazole is COc1ccccc1-c1cnc(CC2CNC2)o1.
What is the InChIKey of 2-(azetidin-3-ylmethyl)-5-(2-methoxyphenyl)-1,3-oxazole?
The InChIKey is WHYNWSNIABULDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-17-12-5-3-2-4-11(12)13-9-16-14(18-13)6-10-7-15-8-10/h2-5,9-10,15H,6-8H2,1H3.
What are the key properties of 2-(azetidin-3-ylmethyl)-5-(2-methoxyphenyl)-1,3-oxazole?
2-(azetidin-3-ylmethyl)-5-(2-methoxyphenyl)-1,3-oxazole has a molecular weight of 244.29 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-ylmethyl)-5-(2-methoxyphenyl)-1,3-oxazole is sourced from PubChem (CID 115045283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).