1-cyclobutyl-4-(5-methyl-1H-pyrazol-3-yl)piperazine

C12H20N4 — CID 99842589

IUPAC1-cyclobutyl-4-(5-methyl-1H-pyrazol-3-yl)piperazine
SMILESCc1cc(N2CCN(C3CCC3)CC2)n[nH]1
InChIInChI=1S/C12H20N4/c1-10-9-12(14-13-10)16-7-5-15(6-8-16)11-3-2-4-11/h9,11H,2-8H2,1H3,(H,13,14)
InChIKeySGIVMMWDMISJCR-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.39
Rot. Bonds2

About 1-cyclobutyl-4-(5-methyl-1H-pyrazol-3-yl)piperazine

1-cyclobutyl-4-(5-methyl-1H-pyrazol-3-yl)piperazine (PubChem CID 99842589) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-cyclobutyl-4-(5-methyl-1H-pyrazol-3-yl)piperazine.

Molecular Properties

Compound Name1-cyclobutyl-4-(5-methyl-1H-pyrazol-3-yl)piperazine
PubChem CID99842589
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name1-cyclobutyl-4-(5-methyl-1H-pyrazol-3-yl)piperazine
SMILESCc1cc(N2CCN(C3CCC3)CC2)n[nH]1
InChIInChI=1S/C12H20N4/c1-10-9-12(14-13-10)16-7-5-15(6-8-16)11-3-2-4-11/h9,11H,2-8H2,1H3,(H,13,14)
InChIKeySGIVMMWDMISJCR-UHFFFAOYSA-N
XLogP1.39
TPSA35.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-4-(5-methyl-1H-pyrazol-3-yl)piperazine?
The IUPAC name of 1-cyclobutyl-4-(5-methyl-1H-pyrazol-3-yl)piperazine (CID 99842589) is 1-cyclobutyl-4-(5-methyl-1H-pyrazol-3-yl)piperazine.
What is the SMILES notation for 1-cyclobutyl-4-(5-methyl-1H-pyrazol-3-yl)piperazine?
The canonical SMILES for 1-cyclobutyl-4-(5-methyl-1H-pyrazol-3-yl)piperazine is Cc1cc(N2CCN(C3CCC3)CC2)n[nH]1.
What is the InChIKey of 1-cyclobutyl-4-(5-methyl-1H-pyrazol-3-yl)piperazine?
The InChIKey is SGIVMMWDMISJCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-10-9-12(14-13-10)16-7-5-15(6-8-16)11-3-2-4-11/h9,11H,2-8H2,1H3,(H,13,14).
What are the key properties of 1-cyclobutyl-4-(5-methyl-1H-pyrazol-3-yl)piperazine?
1-cyclobutyl-4-(5-methyl-1H-pyrazol-3-yl)piperazine has a molecular weight of 220.32 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-4-(5-methyl-1H-pyrazol-3-yl)piperazine is sourced from PubChem (CID 99842589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).