1-methyl-4-[3-(1-methylpyrazol-4-yl)phenyl]piperazine

C15H20N4 — CID 137468196

IUPAC1-methyl-4-[3-(1-methylpyrazol-4-yl)phenyl]piperazine
SMILESCN1CCN(c2cccc(-c3cnn(C)c3)c2)CC1
InChIInChI=1S/C15H20N4/c1-17-6-8-19(9-7-17)15-5-3-4-13(10-15)14-11-16-18(2)12-14/h3-5,10-12H,6-9H2,1-2H3
InChIKeyZZXGPIKOFOOMPH-UHFFFAOYSA-N
MW256.35 g/mol
LogP1.84
Rot. Bonds2

About 1-methyl-4-[3-(1-methylpyrazol-4-yl)phenyl]piperazine

1-methyl-4-[3-(1-methylpyrazol-4-yl)phenyl]piperazine (PubChem CID 137468196) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 1-methyl-4-[3-(1-methylpyrazol-4-yl)phenyl]piperazine.

Molecular Properties

Compound Name1-methyl-4-[3-(1-methylpyrazol-4-yl)phenyl]piperazine
PubChem CID137468196
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name1-methyl-4-[3-(1-methylpyrazol-4-yl)phenyl]piperazine
SMILESCN1CCN(c2cccc(-c3cnn(C)c3)c2)CC1
InChIInChI=1S/C15H20N4/c1-17-6-8-19(9-7-17)15-5-3-4-13(10-15)14-11-16-18(2)12-14/h3-5,10-12H,6-9H2,1-2H3
InChIKeyZZXGPIKOFOOMPH-UHFFFAOYSA-N
XLogP1.84
TPSA24.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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1-tert-butyl-4-(3-pyrrolidin-1-ylphenyl)pyrazole
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1-[3-(2,6-dichlorophenyl)phenyl]-4-methylpiperazine
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4-[3-(4-methylpiperazin-1-yl)phenyl]-1H-pyrazol-5-amine
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N-[3-(4-methylpiperazin-1-yl)phenyl]-7-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-2-amine
CID 66711644
N-methyl-3-(1-methylpyrazol-4-yl)aniline
CID 106505763
1-methyl-4-(4-phenylphenyl)pyrazole
CID 135064285
[3-(1-methylpyrazol-4-yl)phenyl]methanamine
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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-[3-(1-methylpyrazol-4-yl)phenyl]piperazine?
The IUPAC name of 1-methyl-4-[3-(1-methylpyrazol-4-yl)phenyl]piperazine (CID 137468196) is 1-methyl-4-[3-(1-methylpyrazol-4-yl)phenyl]piperazine.
What is the SMILES notation for 1-methyl-4-[3-(1-methylpyrazol-4-yl)phenyl]piperazine?
The canonical SMILES for 1-methyl-4-[3-(1-methylpyrazol-4-yl)phenyl]piperazine is CN1CCN(c2cccc(-c3cnn(C)c3)c2)CC1.
What is the InChIKey of 1-methyl-4-[3-(1-methylpyrazol-4-yl)phenyl]piperazine?
The InChIKey is ZZXGPIKOFOOMPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-17-6-8-19(9-7-17)15-5-3-4-13(10-15)14-11-16-18(2)12-14/h3-5,10-12H,6-9H2,1-2H3.
What are the key properties of 1-methyl-4-[3-(1-methylpyrazol-4-yl)phenyl]piperazine?
1-methyl-4-[3-(1-methylpyrazol-4-yl)phenyl]piperazine has a molecular weight of 256.35 g/mol, XLogP of 1.84, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-[3-(1-methylpyrazol-4-yl)phenyl]piperazine is sourced from PubChem (CID 137468196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).