1-[1-(5-cyclopropyl-1H-pyrazol-4-yl)ethyl]piperazine

C12H20N4 — CID 83889597

IUPAC1-[1-(5-cyclopropyl-1H-pyrazol-4-yl)ethyl]piperazine
SMILESCC(c1cn[nH]c1C1CC1)N1CCNCC1
InChIInChI=1S/C12H20N4/c1-9(16-6-4-13-5-7-16)11-8-14-15-12(11)10-2-3-10/h8-10,13H,2-7H2,1H3,(H,14,15)
InChIKeyDCSBUOOFBQNFSR-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.25
Rot. Bonds3

About 1-[1-(5-cyclopropyl-1H-pyrazol-4-yl)ethyl]piperazine

1-[1-(5-cyclopropyl-1H-pyrazol-4-yl)ethyl]piperazine (PubChem CID 83889597) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-[1-(5-cyclopropyl-1H-pyrazol-4-yl)ethyl]piperazine.

Molecular Properties

Compound Name1-[1-(5-cyclopropyl-1H-pyrazol-4-yl)ethyl]piperazine
PubChem CID83889597
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name1-[1-(5-cyclopropyl-1H-pyrazol-4-yl)ethyl]piperazine
SMILESCC(c1cn[nH]c1C1CC1)N1CCNCC1
InChIInChI=1S/C12H20N4/c1-9(16-6-4-13-5-7-16)11-8-14-15-12(11)10-2-3-10/h8-10,13H,2-7H2,1H3,(H,14,15)
InChIKeyDCSBUOOFBQNFSR-UHFFFAOYSA-N
XLogP1.25
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(5-cyclopropyl-1H-pyrazol-4-yl)ethyl]piperazine?
The IUPAC name of 1-[1-(5-cyclopropyl-1H-pyrazol-4-yl)ethyl]piperazine (CID 83889597) is 1-[1-(5-cyclopropyl-1H-pyrazol-4-yl)ethyl]piperazine.
What is the SMILES notation for 1-[1-(5-cyclopropyl-1H-pyrazol-4-yl)ethyl]piperazine?
The canonical SMILES for 1-[1-(5-cyclopropyl-1H-pyrazol-4-yl)ethyl]piperazine is CC(c1cn[nH]c1C1CC1)N1CCNCC1.
What is the InChIKey of 1-[1-(5-cyclopropyl-1H-pyrazol-4-yl)ethyl]piperazine?
The InChIKey is DCSBUOOFBQNFSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-9(16-6-4-13-5-7-16)11-8-14-15-12(11)10-2-3-10/h8-10,13H,2-7H2,1H3,(H,14,15).
What are the key properties of 1-[1-(5-cyclopropyl-1H-pyrazol-4-yl)ethyl]piperazine?
1-[1-(5-cyclopropyl-1H-pyrazol-4-yl)ethyl]piperazine has a molecular weight of 220.32 g/mol, XLogP of 1.25, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(5-cyclopropyl-1H-pyrazol-4-yl)ethyl]piperazine is sourced from PubChem (CID 83889597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).