5-methyl-2-propan-2-yl-1-(1-propan-2-ylpyrazol-4-yl)piperazine

C14H26N4 — CID 64937028

IUPAC5-methyl-2-propan-2-yl-1-(1-propan-2-ylpyrazol-4-yl)piperazine
SMILESCC1CN(c2cnn(C(C)C)c2)C(C(C)C)CN1
InChIInChI=1S/C14H26N4/c1-10(2)14-7-15-12(5)8-17(14)13-6-16-18(9-13)11(3)4/h6,9-12,14-15H,7-8H2,1-5H3
InChIKeyARGHRVZHSIIEJX-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.29
Rot. Bonds3

About 5-methyl-2-propan-2-yl-1-(1-propan-2-ylpyrazol-4-yl)piperazine

5-methyl-2-propan-2-yl-1-(1-propan-2-ylpyrazol-4-yl)piperazine (PubChem CID 64937028) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 5-methyl-2-propan-2-yl-1-(1-propan-2-ylpyrazol-4-yl)piperazine.

Molecular Properties

Compound Name5-methyl-2-propan-2-yl-1-(1-propan-2-ylpyrazol-4-yl)piperazine
PubChem CID64937028
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name5-methyl-2-propan-2-yl-1-(1-propan-2-ylpyrazol-4-yl)piperazine
SMILESCC1CN(c2cnn(C(C)C)c2)C(C(C)C)CN1
InChIInChI=1S/C14H26N4/c1-10(2)14-7-15-12(5)8-17(14)13-6-16-18(9-13)11(3)4/h6,9-12,14-15H,7-8H2,1-5H3
InChIKeyARGHRVZHSIIEJX-UHFFFAOYSA-N
XLogP2.29
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-1-(5-methyl-3-pyridinyl)-2-propan-2-ylpiperazine
CID 107586964
1-(4-fluorophenyl)-5-methyl-2-propan-2-ylpiperazine
CID 64953690
5-methyl-2-propan-2-yl-1-thiophen-3-ylpiperazine
CID 66356270
5-ethyl-1-(1-ethylpyrazol-4-yl)-2-propan-2-ylpiperazine
CID 64935799
1-(4-fluoro-3-methylphenyl)-5-methyl-2-propan-2-ylpiperazine
CID 64936447
1-(3-chloro-5-fluorophenyl)-5-methyl-2-propan-2-ylpiperazine
CID 107370881
1-(2-chlorophenyl)-5-methyl-2-propan-2-ylpiperazine
CID 64937906
1-(2-fluorophenyl)-5-methyl-2-propan-2-ylpiperazine
CID 64953891
3-cyclohexyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine
CID 64951986
1-(2,4-dibromophenyl)-5-methyl-2-propan-2-ylpiperazine
CID 64937159
1-(2,4-difluorophenyl)-5-methyl-2-propan-2-ylpiperazine
CID 64954077
2-ethyl-1-(1-ethylpyrazol-4-yl)-5-methylpiperazine
CID 64939217

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-propan-2-yl-1-(1-propan-2-ylpyrazol-4-yl)piperazine?
The IUPAC name of 5-methyl-2-propan-2-yl-1-(1-propan-2-ylpyrazol-4-yl)piperazine (CID 64937028) is 5-methyl-2-propan-2-yl-1-(1-propan-2-ylpyrazol-4-yl)piperazine.
What is the SMILES notation for 5-methyl-2-propan-2-yl-1-(1-propan-2-ylpyrazol-4-yl)piperazine?
The canonical SMILES for 5-methyl-2-propan-2-yl-1-(1-propan-2-ylpyrazol-4-yl)piperazine is CC1CN(c2cnn(C(C)C)c2)C(C(C)C)CN1.
What is the InChIKey of 5-methyl-2-propan-2-yl-1-(1-propan-2-ylpyrazol-4-yl)piperazine?
The InChIKey is ARGHRVZHSIIEJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-10(2)14-7-15-12(5)8-17(14)13-6-16-18(9-13)11(3)4/h6,9-12,14-15H,7-8H2,1-5H3.
What are the key properties of 5-methyl-2-propan-2-yl-1-(1-propan-2-ylpyrazol-4-yl)piperazine?
5-methyl-2-propan-2-yl-1-(1-propan-2-ylpyrazol-4-yl)piperazine has a molecular weight of 250.39 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-propan-2-yl-1-(1-propan-2-ylpyrazol-4-yl)piperazine is sourced from PubChem (CID 64937028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).