3-cyclopropyl-5-piperazin-1-yl-1,2-oxazole

C10H15N3O — CID 83669736

IUPAC3-cyclopropyl-5-piperazin-1-yl-1,2-oxazole
SMILESc1c(C2CC2)noc1N1CCNCC1
InChIInChI=1S/C10H15N3O/c1-2-8(1)9-7-10(14-12-9)13-5-3-11-4-6-13/h7-8,11H,1-6H2
InChIKeyIOLVDFHSZBQIGO-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.96
Rot. Bonds2

About 3-cyclopropyl-5-piperazin-1-yl-1,2-oxazole

3-cyclopropyl-5-piperazin-1-yl-1,2-oxazole (PubChem CID 83669736) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 3-cyclopropyl-5-piperazin-1-yl-1,2-oxazole.

Molecular Properties

Compound Name3-cyclopropyl-5-piperazin-1-yl-1,2-oxazole
PubChem CID83669736
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name3-cyclopropyl-5-piperazin-1-yl-1,2-oxazole
SMILESc1c(C2CC2)noc1N1CCNCC1
InChIInChI=1S/C10H15N3O/c1-2-8(1)9-7-10(14-12-9)13-5-3-11-4-6-13/h7-8,11H,1-6H2
InChIKeyIOLVDFHSZBQIGO-UHFFFAOYSA-N
XLogP0.96
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-5-piperazin-1-yl-1,2-oxazole?
The IUPAC name of 3-cyclopropyl-5-piperazin-1-yl-1,2-oxazole (CID 83669736) is 3-cyclopropyl-5-piperazin-1-yl-1,2-oxazole.
What is the SMILES notation for 3-cyclopropyl-5-piperazin-1-yl-1,2-oxazole?
The canonical SMILES for 3-cyclopropyl-5-piperazin-1-yl-1,2-oxazole is c1c(C2CC2)noc1N1CCNCC1.
What is the InChIKey of 3-cyclopropyl-5-piperazin-1-yl-1,2-oxazole?
The InChIKey is IOLVDFHSZBQIGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-2-8(1)9-7-10(14-12-9)13-5-3-11-4-6-13/h7-8,11H,1-6H2.
What are the key properties of 3-cyclopropyl-5-piperazin-1-yl-1,2-oxazole?
3-cyclopropyl-5-piperazin-1-yl-1,2-oxazole has a molecular weight of 193.25 g/mol, XLogP of 0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-5-piperazin-1-yl-1,2-oxazole is sourced from PubChem (CID 83669736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).