2-cyclopropyl-5-piperazin-1-yl-1,3,4-oxadiazole

C9H14N4O — CID 28808827

IUPAC2-cyclopropyl-5-piperazin-1-yl-1,3,4-oxadiazole
SMILESC1CN(c2nnc(C3CC3)o2)CCN1
InChIInChI=1S/C9H14N4O/c1-2-7(1)8-11-12-9(14-8)13-5-3-10-4-6-13/h7,10H,1-6H2
InChIKeyPRRLIVROYKMVCK-UHFFFAOYSA-N
MW194.24 g/mol
LogP0.36
Rot. Bonds2

About 2-cyclopropyl-5-piperazin-1-yl-1,3,4-oxadiazole

2-cyclopropyl-5-piperazin-1-yl-1,3,4-oxadiazole (PubChem CID 28808827) has the molecular formula C9H14N4O and a molecular weight of 194.24 g/mol. Its IUPAC name is 2-cyclopropyl-5-piperazin-1-yl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-cyclopropyl-5-piperazin-1-yl-1,3,4-oxadiazole
PubChem CID28808827
Molecular FormulaC9H14N4O
Molecular Weight194.24 g/mol
Exact Mass194.12
IUPAC Name2-cyclopropyl-5-piperazin-1-yl-1,3,4-oxadiazole
SMILESC1CN(c2nnc(C3CC3)o2)CCN1
InChIInChI=1S/C9H14N4O/c1-2-7(1)8-11-12-9(14-8)13-5-3-10-4-6-13/h7,10H,1-6H2
InChIKeyPRRLIVROYKMVCK-UHFFFAOYSA-N
XLogP0.36
TPSA54.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-Ethyl-5-piperazin-1-yl-1,3,4-oxadiazole
CID 28808823
1-(5-Cyclopropyl-1,3,4-oxadiazol-2-yl)piperidin-2-amine
CID 176131461
3-[5-(4-Methylpiperazin-1-yl)-1,3,4-oxadiazol-2-yl]propan-1-amine
CID 24255126
2-Methyl-1-[5-(4-methylpiperazin-1-yl)-1,3,4-oxadiazol-2-yl]propan-1-amine
CID 24255157
2-Piperazin-1-yl-5-propan-2-yl-1,3,4-oxadiazole
CID 28808825
2-(2-Methylpropyl)-5-piperazin-1-yl-1,3,4-oxadiazole
CID 28808829
2-Tert-butyl-5-piperazin-1-yl-1,3,4-oxadiazole
CID 28808833
N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-piperazin-1-ylacetamide
CID 43162325
1-(5-Ethyl-1,3,4-oxadiazol-2-yl)piperazine hydrochloride
CID 52988216
1-(5-Isopropyl-1,3,4-oxadiazol-2-yl)piperazine hcl
CID 52988217
2-amino-N-[2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl]acetamide
CID 61254463
N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-(2-methylpiperazin-1-yl)acetamide
CID 62673350

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5-piperazin-1-yl-1,3,4-oxadiazole?
The IUPAC name of 2-cyclopropyl-5-piperazin-1-yl-1,3,4-oxadiazole (CID 28808827) is 2-cyclopropyl-5-piperazin-1-yl-1,3,4-oxadiazole.
What is the SMILES notation for 2-cyclopropyl-5-piperazin-1-yl-1,3,4-oxadiazole?
The canonical SMILES for 2-cyclopropyl-5-piperazin-1-yl-1,3,4-oxadiazole is C1CN(c2nnc(C3CC3)o2)CCN1.
What is the InChIKey of 2-cyclopropyl-5-piperazin-1-yl-1,3,4-oxadiazole?
The InChIKey is PRRLIVROYKMVCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O/c1-2-7(1)8-11-12-9(14-8)13-5-3-10-4-6-13/h7,10H,1-6H2.
What are the key properties of 2-cyclopropyl-5-piperazin-1-yl-1,3,4-oxadiazole?
2-cyclopropyl-5-piperazin-1-yl-1,3,4-oxadiazole has a molecular weight of 194.24 g/mol, XLogP of 0.36, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5-piperazin-1-yl-1,3,4-oxadiazole is sourced from PubChem (CID 28808827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).