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

C10H17N3O — CID 83698825

IUPAC3-piperazin-1-yl-5-propyl-1,2-oxazole
SMILESCCCc1cc(N2CCNCC2)no1
InChIInChI=1S/C10H17N3O/c1-2-3-9-8-10(12-14-9)13-6-4-11-5-7-13/h8,11H,2-7H2,1H3
InChIKeyCYQDTBJUIZVDIX-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.04
Rot. Bonds3

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

3-piperazin-1-yl-5-propyl-1,2-oxazole (PubChem CID 83698825) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 3-piperazin-1-yl-5-propyl-1,2-oxazole.

Molecular Properties

Compound Name3-piperazin-1-yl-5-propyl-1,2-oxazole
PubChem CID83698825
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name3-piperazin-1-yl-5-propyl-1,2-oxazole
SMILESCCCc1cc(N2CCNCC2)no1
InChIInChI=1S/C10H17N3O/c1-2-3-9-8-10(12-14-9)13-6-4-11-5-7-13/h8,11H,2-7H2,1H3
InChIKeyCYQDTBJUIZVDIX-UHFFFAOYSA-N
XLogP1.04
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-piperazin-1-yl-5-propan-2-yl-1,2-oxazole
CID 83669738
1-(5-propyl-1H-pyrazol-3-yl)piperazine
CID 83698652
5-piperazin-1-yl-3-propyl-1,2,4-oxadiazole
CID 118396401
5-(2-piperazin-1-yl-4-pyridinyl)-3-propyl-1,2,4-oxadiazole
CID 56686520
5-piperazin-1-yl-3-propyl-1,2,4-triazine
CID 116823993
1-(5-propyl-2-pyridinyl)piperazine
CID 152988088
5-(6-piperazin-1-yl-3-pyridinyl)-3-propyl-1,2,4-oxadiazole
CID 56686529
5-hydroxy-5-methyl-1-(5-propyl-1,2-oxazol-3-yl)imidazolidin-2-one
CID 70555660
3-methyl-5-(3-piperazin-1-ylpropyl)-1,2-oxazole
CID 141146127
3-butyl-5-piperazin-1-yl-1,2,4-oxadiazole
CID 118396397
4-hydroxy-1-methyl-3-(5-propyl-1,2-oxazol-3-yl)imidazolidin-2-one
CID 70554763
2-(4-chlorophenyl)-4-piperazin-1-yl-6-propylpyrimidine
CID 56766948

Frequently Asked Questions

What is the IUPAC name of 3-piperazin-1-yl-5-propyl-1,2-oxazole?
The IUPAC name of 3-piperazin-1-yl-5-propyl-1,2-oxazole (CID 83698825) is 3-piperazin-1-yl-5-propyl-1,2-oxazole.
What is the SMILES notation for 3-piperazin-1-yl-5-propyl-1,2-oxazole?
The canonical SMILES for 3-piperazin-1-yl-5-propyl-1,2-oxazole is CCCc1cc(N2CCNCC2)no1.
What is the InChIKey of 3-piperazin-1-yl-5-propyl-1,2-oxazole?
The InChIKey is CYQDTBJUIZVDIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-2-3-9-8-10(12-14-9)13-6-4-11-5-7-13/h8,11H,2-7H2,1H3.
What are the key properties of 3-piperazin-1-yl-5-propyl-1,2-oxazole?
3-piperazin-1-yl-5-propyl-1,2-oxazole has a molecular weight of 195.27 g/mol, XLogP of 1.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperazin-1-yl-5-propyl-1,2-oxazole is sourced from PubChem (CID 83698825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).