3-methyl-5-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-1,2-oxazole

C15H19N3O2 — CID 77094813

IUPAC3-methyl-5-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-1,2-oxazole
SMILESCc1cc(CN2CCC(Oc3cccnc3)CC2)on1
InChIInChI=1S/C15H19N3O2/c1-12-9-15(20-17-12)11-18-7-4-13(5-8-18)19-14-3-2-6-16-10-14/h2-3,6,9-10,13H,4-5,7-8,11H2,1H3
InChIKeyNVFRCIDHGAGWFC-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.42
Rot. Bonds4

About 3-methyl-5-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-1,2-oxazole

3-methyl-5-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-1,2-oxazole (PubChem CID 77094813) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 3-methyl-5-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-1,2-oxazole.

Molecular Properties

Compound Name3-methyl-5-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-1,2-oxazole
PubChem CID77094813
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name3-methyl-5-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-1,2-oxazole
SMILESCc1cc(CN2CCC(Oc3cccnc3)CC2)on1
InChIInChI=1S/C15H19N3O2/c1-12-9-15(20-17-12)11-18-7-4-13(5-8-18)19-14-3-2-6-16-10-14/h2-3,6,9-10,13H,4-5,7-8,11H2,1H3
InChIKeyNVFRCIDHGAGWFC-UHFFFAOYSA-N
XLogP2.42
TPSA51.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-methyl-5-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-1,2-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 3-methyl-5-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-1,2-oxazole?
The IUPAC name of 3-methyl-5-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-1,2-oxazole (CID 77094813) is 3-methyl-5-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-1,2-oxazole.
What is the SMILES notation for 3-methyl-5-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-1,2-oxazole?
The canonical SMILES for 3-methyl-5-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-1,2-oxazole is Cc1cc(CN2CCC(Oc3cccnc3)CC2)on1.
What is the InChIKey of 3-methyl-5-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-1,2-oxazole?
The InChIKey is NVFRCIDHGAGWFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-12-9-15(20-17-12)11-18-7-4-13(5-8-18)19-14-3-2-6-16-10-14/h2-3,6,9-10,13H,4-5,7-8,11H2,1H3.
What are the key properties of 3-methyl-5-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-1,2-oxazole?
3-methyl-5-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-1,2-oxazole has a molecular weight of 273.34 g/mol, XLogP of 2.42, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-[(4-pyridin-3-yloxypiperidin-1-yl)methyl]-1,2-oxazole is sourced from PubChem (CID 77094813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).