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

C12H22N4 — CID 64935026

IUPAC5-ethyl-1-(1-ethylpyrazol-4-yl)-2-methylpiperazine
SMILESCCC1CN(c2cnn(CC)c2)C(C)CN1
InChIInChI=1S/C12H22N4/c1-4-11-8-16(10(3)6-13-11)12-7-14-15(5-2)9-12/h7,9-11,13H,4-6,8H2,1-3H3
InChIKeyCPNWERVNVIRBGW-UHFFFAOYSA-N
MW222.34 g/mol
LogP1.48
Rot. Bonds3

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

5-ethyl-1-(1-ethylpyrazol-4-yl)-2-methylpiperazine (PubChem CID 64935026) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is 5-ethyl-1-(1-ethylpyrazol-4-yl)-2-methylpiperazine.

Molecular Properties

Compound Name5-ethyl-1-(1-ethylpyrazol-4-yl)-2-methylpiperazine
PubChem CID64935026
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC Name5-ethyl-1-(1-ethylpyrazol-4-yl)-2-methylpiperazine
SMILESCCC1CN(c2cnn(CC)c2)C(C)CN1
InChIInChI=1S/C12H22N4/c1-4-11-8-16(10(3)6-13-11)12-7-14-15(5-2)9-12/h7,9-11,13H,4-6,8H2,1-3H3
InChIKeyCPNWERVNVIRBGW-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-propan-2-ylpiperazine
CID 64935799
2-ethyl-1-(1-ethylpyrazol-4-yl)-5-methylpiperazine
CID 64939217
2,5-diethyl-1-[1-(1-ethylpyrazol-4-yl)ethyl]piperazine
CID 64977920
N-ethyl-1-(1-ethylpyrazol-4-yl)-2-methylpiperidin-4-amine
CID 54975441
5-ethyl-2-methyl-1-[3-(trifluoromethyl)phenyl]piperazine
CID 64930789
1-(2,6-difluorophenyl)-5-ethyl-2-methylpiperazine
CID 64934794
3-cyclopropyl-1-(1-ethylpyrazol-4-yl)-6-methylpiperazine-2,5-dione
CID 64961148
1-(3,4-dichlorophenyl)-2-methyl-5-propylpiperazine
CID 64933320
8-ethyl-6-[(1-ethylpyrazol-4-yl)methyl]-6,9-diazaspiro[4.5]decane
CID 64841020
2-ethyl-1-[(1-ethylpyrazol-4-yl)methyl]-5-propylpiperazine
CID 64846772
3-benzyl-1-(1-ethylpyrazol-4-yl)-1,4-diazepane
CID 64945318

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1-(1-ethylpyrazol-4-yl)-2-methylpiperazine?
The IUPAC name of 5-ethyl-1-(1-ethylpyrazol-4-yl)-2-methylpiperazine (CID 64935026) is 5-ethyl-1-(1-ethylpyrazol-4-yl)-2-methylpiperazine.
What is the SMILES notation for 5-ethyl-1-(1-ethylpyrazol-4-yl)-2-methylpiperazine?
The canonical SMILES for 5-ethyl-1-(1-ethylpyrazol-4-yl)-2-methylpiperazine is CCC1CN(c2cnn(CC)c2)C(C)CN1.
What is the InChIKey of 5-ethyl-1-(1-ethylpyrazol-4-yl)-2-methylpiperazine?
The InChIKey is CPNWERVNVIRBGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-4-11-8-16(10(3)6-13-11)12-7-14-15(5-2)9-12/h7,9-11,13H,4-6,8H2,1-3H3.
What are the key properties of 5-ethyl-1-(1-ethylpyrazol-4-yl)-2-methylpiperazine?
5-ethyl-1-(1-ethylpyrazol-4-yl)-2-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 5-ethyl-1-(1-ethylpyrazol-4-yl)-2-methylpiperazine is sourced from PubChem (CID 64935026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).