2-(3-methoxyphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole

C14H17N3O2 — CID 22308678

IUPAC2-(3-methoxyphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole
SMILESCOc1cccc(-c2nnc(C3CCNCC3)o2)c1
InChIInChI=1S/C14H17N3O2/c1-18-12-4-2-3-11(9-12)14-17-16-13(19-14)10-5-7-15-8-6-10/h2-4,9-10,15H,5-8H2,1H3
InChIKeyHXFGBVXFRXENGM-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.21
Rot. Bonds3

About 2-(3-methoxyphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole

2-(3-methoxyphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole (PubChem CID 22308678) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole
PubChem CID22308678
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name2-(3-methoxyphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole
SMILESCOc1cccc(-c2nnc(C3CCNCC3)o2)c1
InChIInChI=1S/C14H17N3O2/c1-18-12-4-2-3-11(9-12)14-17-16-13(19-14)10-5-7-15-8-6-10/h2-4,9-10,15H,5-8H2,1H3
InChIKeyHXFGBVXFRXENGM-UHFFFAOYSA-N
XLogP2.21
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(3-methoxyphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole with MolForge

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

Launch Full Analysis

Related Compounds

2-(4-methoxyphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole
CID 22308679
cyclopropyl-[4-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone
CID 99963492
3-(3-methoxyphenyl)-5-piperidin-4-yl-1,2,4-oxadiazole
CID 28805640
1-[(3R)-3-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]propan-1-one
CID 99963843
2-[1-(4-ethoxyphenyl)sulfonylpiperidin-4-yl]-5-(3-methoxyphenyl)-1,3,4-oxadiazole
CID 99963344
2-(4-ethylphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole
CID 39359301
3-(3-methoxyphenyl)-5-pyrrolidin-3-yl-1,2,4-oxadiazole
CID 63032530
2-(6-methoxynaphthalen-2-yl)-5-(3-methoxyphenyl)-1,3,4-oxadiazole
CID 11348131
3-(3-methoxyphenyl)-5-[(3S)-pyrrolidin-3-yl]-1,2,4-oxadiazole;hydrochloride
CID 120841699
2-[1-(2,5-dimethoxyphenyl)sulfonylpiperidin-3-yl]-5-(3-methoxyphenyl)-1,3,4-oxadiazole
CID 132675744
2-[1-(3,4-dimethoxyphenyl)sulfonylpiperidin-3-yl]-5-(3-methoxyphenyl)-1,3,4-oxadiazole
CID 132675747
2-(3,5-diiodophenyl)-5-(3-methoxyphenyl)-1,3,4-oxadiazole
CID 67510995

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole?
The IUPAC name of 2-(3-methoxyphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole (CID 22308678) is 2-(3-methoxyphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole.
What is the SMILES notation for 2-(3-methoxyphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole?
The canonical SMILES for 2-(3-methoxyphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole is COc1cccc(-c2nnc(C3CCNCC3)o2)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole?
The InChIKey is HXFGBVXFRXENGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-18-12-4-2-3-11(9-12)14-17-16-13(19-14)10-5-7-15-8-6-10/h2-4,9-10,15H,5-8H2,1H3.
What are the key properties of 2-(3-methoxyphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole?
2-(3-methoxyphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole has a molecular weight of 259.31 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-5-piperidin-4-yl-1,3,4-oxadiazole is sourced from PubChem (CID 22308678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).