2-(furan-2-yl)-5-(piperazin-1-ylmethyl)-1,3,4-oxadiazole

C11H14N4O2 — CID 43090469

IUPAC2-(furan-2-yl)-5-(piperazin-1-ylmethyl)-1,3,4-oxadiazole
SMILESc1coc(-c2nnc(CN3CCNCC3)o2)c1
InChIInChI=1S/C11H14N4O2/c1-2-9(16-7-1)11-14-13-10(17-11)8-15-5-3-12-4-6-15/h1-2,7,12H,3-6,8H2
InChIKeyTWLHCZLYWVOLJZ-UHFFFAOYSA-N
MW234.26 g/mol
LogP0.73
Rot. Bonds3

About 2-(furan-2-yl)-5-(piperazin-1-ylmethyl)-1,3,4-oxadiazole

2-(furan-2-yl)-5-(piperazin-1-ylmethyl)-1,3,4-oxadiazole (PubChem CID 43090469) has the molecular formula C11H14N4O2 and a molecular weight of 234.26 g/mol. Its IUPAC name is 2-(furan-2-yl)-5-(piperazin-1-ylmethyl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(furan-2-yl)-5-(piperazin-1-ylmethyl)-1,3,4-oxadiazole
PubChem CID43090469
Molecular FormulaC11H14N4O2
Molecular Weight234.26 g/mol
Exact Mass234.11
IUPAC Name2-(furan-2-yl)-5-(piperazin-1-ylmethyl)-1,3,4-oxadiazole
SMILESc1coc(-c2nnc(CN3CCNCC3)o2)c1
InChIInChI=1S/C11H14N4O2/c1-2-9(16-7-1)11-14-13-10(17-11)8-15-5-3-12-4-6-15/h1-2,7,12H,3-6,8H2
InChIKeyTWLHCZLYWVOLJZ-UHFFFAOYSA-N
XLogP0.73
TPSA67.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(furan-2-yl)-5-(piperazin-1-ylmethyl)-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-(furan-2-yl)-5-[[4-(3-methylbutyl)piperazin-1-yl]methyl]-1,3,4-oxadiazole
CID 53497956
2-[(3,5-dimethylpiperazin-1-yl)methyl]-5-(furan-2-yl)-1,3,4-oxadiazole
CID 63873892
furan-2-yl-[4-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]piperazin-1-yl]methanone
CID 26495653
1-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-4-methylazepan-4-ol
CID 107408294
[4-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]morpholin-2-yl]methanol
CID 79833803
(4-fluorophenyl)-[4-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]piperazin-1-yl]methanone
CID 36875761
2-[(4-benzylsulfonylpiperazin-1-yl)methyl]-5-(furan-2-yl)-1,3,4-oxadiazole
CID 9442964
1-[4-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]piperazin-1-yl]-2-morpholin-4-ylethanone
CID 35486547
2-(furan-2-yl)-5-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]-1,3,4-oxadiazole
CID 4827831
2-[[4-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-yl)piperidin-1-yl]methyl]-5-(furan-2-yl)-1,3,4-oxadiazole
CID 56817361
(4-ethylphenyl)-[4-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]piperazin-1-yl]methanone
CID 35127035
3-amino-1-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]pyrrolidine-3-carboxylic acid
CID 107324790

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-5-(piperazin-1-ylmethyl)-1,3,4-oxadiazole?
The IUPAC name of 2-(furan-2-yl)-5-(piperazin-1-ylmethyl)-1,3,4-oxadiazole (CID 43090469) is 2-(furan-2-yl)-5-(piperazin-1-ylmethyl)-1,3,4-oxadiazole.
What is the SMILES notation for 2-(furan-2-yl)-5-(piperazin-1-ylmethyl)-1,3,4-oxadiazole?
The canonical SMILES for 2-(furan-2-yl)-5-(piperazin-1-ylmethyl)-1,3,4-oxadiazole is c1coc(-c2nnc(CN3CCNCC3)o2)c1.
What is the InChIKey of 2-(furan-2-yl)-5-(piperazin-1-ylmethyl)-1,3,4-oxadiazole?
The InChIKey is TWLHCZLYWVOLJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2/c1-2-9(16-7-1)11-14-13-10(17-11)8-15-5-3-12-4-6-15/h1-2,7,12H,3-6,8H2.
What are the key properties of 2-(furan-2-yl)-5-(piperazin-1-ylmethyl)-1,3,4-oxadiazole?
2-(furan-2-yl)-5-(piperazin-1-ylmethyl)-1,3,4-oxadiazole has a molecular weight of 234.26 g/mol, XLogP of 0.73, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-5-(piperazin-1-ylmethyl)-1,3,4-oxadiazole is sourced from PubChem (CID 43090469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).