2-ethyl-1-(1-ethylpyrazol-4-yl)-5-methylpiperazine

C12H22N4 — CID 64939217

IUPAC2-ethyl-1-(1-ethylpyrazol-4-yl)-5-methylpiperazine
SMILESCCC1CNC(C)CN1c1cnn(CC)c1
InChIInChI=1S/C12H22N4/c1-4-11-6-13-10(3)8-16(11)12-7-14-15(5-2)9-12/h7,9-11,13H,4-6,8H2,1-3H3
InChIKeyFCUUHPODMAHVBP-UHFFFAOYSA-N
MW222.34 g/mol
LogP1.48
Rot. Bonds3

About 2-ethyl-1-(1-ethylpyrazol-4-yl)-5-methylpiperazine

2-ethyl-1-(1-ethylpyrazol-4-yl)-5-methylpiperazine (PubChem CID 64939217) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is 2-ethyl-1-(1-ethylpyrazol-4-yl)-5-methylpiperazine.

Molecular Properties

Compound Name2-ethyl-1-(1-ethylpyrazol-4-yl)-5-methylpiperazine
PubChem CID64939217
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC Name2-ethyl-1-(1-ethylpyrazol-4-yl)-5-methylpiperazine
SMILESCCC1CNC(C)CN1c1cnn(CC)c1
InChIInChI=1S/C12H22N4/c1-4-11-6-13-10(3)8-16(11)12-7-14-15(5-2)9-12/h7,9-11,13H,4-6,8H2,1-3H3
InChIKeyFCUUHPODMAHVBP-UHFFFAOYSA-N
XLogP1.48
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,5-diethyl-1-(1-ethylpyrazol-4-yl)piperazine
CID 64936184
5-ethyl-1-(1-ethylpyrazol-4-yl)-2-methylpiperazine
CID 64935026
5-ethyl-1-(1-ethylpyrazol-4-yl)-2-propan-2-ylpiperazine
CID 64935799
2-ethyl-5-methyl-1-(3,4,5-trifluorophenyl)piperazine
CID 64938560
4-(2-ethyl-5-methylpiperazin-1-yl)-N,N-dimethylaniline
CID 64936346
2-ethyl-1-(4-fluoro-3-methylphenyl)-5-methylpiperazine
CID 64939128
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-ethyl-5-methylpiperazine
CID 64954262
2-ethyl-1-(3-fluoro-5-methoxyphenyl)-5-methylpiperazine
CID 114263238
2,5-diethyl-1-[1-(1-ethylpyrazol-4-yl)ethyl]piperazine
CID 64977920
1-[1-(1-ethylpyrazol-4-yl)ethyl]-3-methylpiperazine
CID 65418314
2-ethyl-1-[(1-ethylpyrazol-4-yl)methyl]-5-propylpiperazine
CID 64846772
2-cyclopropyl-1-[(1-ethylpyrazol-4-yl)methyl]-2,5-dimethylpiperazine
CID 64844969

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-(1-ethylpyrazol-4-yl)-5-methylpiperazine?
The IUPAC name of 2-ethyl-1-(1-ethylpyrazol-4-yl)-5-methylpiperazine (CID 64939217) is 2-ethyl-1-(1-ethylpyrazol-4-yl)-5-methylpiperazine.
What is the SMILES notation for 2-ethyl-1-(1-ethylpyrazol-4-yl)-5-methylpiperazine?
The canonical SMILES for 2-ethyl-1-(1-ethylpyrazol-4-yl)-5-methylpiperazine is CCC1CNC(C)CN1c1cnn(CC)c1.
What is the InChIKey of 2-ethyl-1-(1-ethylpyrazol-4-yl)-5-methylpiperazine?
The InChIKey is FCUUHPODMAHVBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-4-11-6-13-10(3)8-16(11)12-7-14-15(5-2)9-12/h7,9-11,13H,4-6,8H2,1-3H3.
What are the key properties of 2-ethyl-1-(1-ethylpyrazol-4-yl)-5-methylpiperazine?
2-ethyl-1-(1-ethylpyrazol-4-yl)-5-methylpiperazine has a molecular weight of 222.34 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-(1-ethylpyrazol-4-yl)-5-methylpiperazine is sourced from PubChem (CID 64939217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).