5-butan-2-yl-1-[2-(2-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpiperazine

C17H32N4 — CID 103016484

IUPAC5-butan-2-yl-1-[2-(2-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpiperazine
SMILESCCC(C)C1CN(CCc2ccnn2C)C(C(C)C)CN1
InChIInChI=1S/C17H32N4/c1-6-14(4)16-12-21(17(11-18-16)13(2)3)10-8-15-7-9-19-20(15)5/h7,9,13-14,16-18H,6,8,10-12H2,1-5H3
InChIKeyUTYWIKKNQSFJRM-UHFFFAOYSA-N
MW292.47 g/mol
LogP2.31
Rot. Bonds6

About 5-butan-2-yl-1-[2-(2-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpiperazine

5-butan-2-yl-1-[2-(2-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpiperazine (PubChem CID 103016484) has the molecular formula C17H32N4 and a molecular weight of 292.47 g/mol. Its IUPAC name is 5-butan-2-yl-1-[2-(2-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name5-butan-2-yl-1-[2-(2-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpiperazine
PubChem CID103016484
Molecular FormulaC17H32N4
Molecular Weight292.47 g/mol
Exact Mass292.26
IUPAC Name5-butan-2-yl-1-[2-(2-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpiperazine
SMILESCCC(C)C1CN(CCc2ccnn2C)C(C(C)C)CN1
InChIInChI=1S/C17H32N4/c1-6-14(4)16-12-21(17(11-18-16)13(2)3)10-8-15-7-9-19-20(15)5/h7,9,13-14,16-18H,6,8,10-12H2,1-5H3
InChIKeyUTYWIKKNQSFJRM-UHFFFAOYSA-N
XLogP2.31
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.47
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-butan-2-yl-1-[2-(2-methylpyrazol-3-yl)ethyl]-5-propylpiperazine
CID 103016284
5-butan-2-yl-1-[(5-methylfuran-2-yl)methyl]-2-propan-2-ylpiperazine
CID 64938181
5-butan-2-yl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-propan-2-ylpiperazine
CID 115943623
5-butan-2-yl-1-(2-ethylhexyl)-2-propan-2-ylpiperazine
CID 64849197
4-[2-[2,5-di(propan-2-yl)piperazin-1-yl]ethyl]-2-methyl-1,3-thiazole
CID 106043362
5-butan-2-yl-1-(2-methyl-3-methylsulfanylpropyl)-2-propan-2-ylpiperazine
CID 64937634
2-cyclopropyl-2-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]-5-propan-2-ylpiperazine
CID 103016338
5-butan-2-yl-2-propan-2-yl-1-pyridin-3-ylpiperazine
CID 64952069
5-butan-2-yl-1-[(4-methylcyclohexyl)methyl]-2-propan-2-ylpiperazine
CID 64937815
1-[2-(2-fluorophenyl)ethyl]-2,5-di(propan-2-yl)piperazine
CID 64953673
6-[2-(2-methylpyrazol-3-yl)ethyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane
CID 103016334
2-[(2-butan-2-yl-5-propan-2-ylpiperazin-1-yl)methyl]pyrimidine
CID 64840780

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-1-[2-(2-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpiperazine?
The IUPAC name of 5-butan-2-yl-1-[2-(2-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpiperazine (CID 103016484) is 5-butan-2-yl-1-[2-(2-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpiperazine.
What is the SMILES notation for 5-butan-2-yl-1-[2-(2-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpiperazine?
The canonical SMILES for 5-butan-2-yl-1-[2-(2-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpiperazine is CCC(C)C1CN(CCc2ccnn2C)C(C(C)C)CN1.
What is the InChIKey of 5-butan-2-yl-1-[2-(2-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpiperazine?
The InChIKey is UTYWIKKNQSFJRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N4/c1-6-14(4)16-12-21(17(11-18-16)13(2)3)10-8-15-7-9-19-20(15)5/h7,9,13-14,16-18H,6,8,10-12H2,1-5H3.
What are the key properties of 5-butan-2-yl-1-[2-(2-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpiperazine?
5-butan-2-yl-1-[2-(2-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpiperazine has a molecular weight of 292.47 g/mol, XLogP of 2.31, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butan-2-yl-1-[2-(2-methylpyrazol-3-yl)ethyl]-2-propan-2-ylpiperazine is sourced from PubChem (CID 103016484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).