1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]piperazine

C11H20N4 — CID 82611840

IUPAC1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]piperazine
SMILESCc1nn(C)cc1CCN1CCNCC1
InChIInChI=1S/C11H20N4/c1-10-11(9-14(2)13-10)3-6-15-7-4-12-5-8-15/h9,12H,3-8H2,1-2H3
InChIKeyOQSOMTJTPXKKSO-UHFFFAOYSA-N
MW208.31 g/mol
LogP0.18
Rot. Bonds3

About 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]piperazine

1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]piperazine (PubChem CID 82611840) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]piperazine.

Molecular Properties

Compound Name1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]piperazine
PubChem CID82611840
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]piperazine
SMILESCc1nn(C)cc1CCN1CCNCC1
InChIInChI=1S/C11H20N4/c1-10-11(9-14(2)13-10)3-6-15-7-4-12-5-8-15/h9,12H,3-8H2,1-2H3
InChIKeyOQSOMTJTPXKKSO-UHFFFAOYSA-N
XLogP0.18
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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1-[(1,3-dimethylpyrazol-4-yl)methyl]piperidine
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1-[2-(2,3,5-trimethylphenyl)ethyl]piperazine
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4,6-dimethyl-2-(2-piperazin-1-ylethyl)pyrimidine
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1-[2-(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]piperazine
CID 117442969
1-[(3-methyl-1-propan-2-ylpyrazol-4-yl)methyl]piperazine
CID 82509495
1-[2-(2-fluoro-3,5-dimethylphenyl)ethyl]piperazine
CID 84798248
1-[2-(1-ethylimidazol-4-yl)ethyl]piperazine
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1-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]piperazine
CID 23005910
1-[2-(5-bromo-2-methylfuran-3-yl)ethyl]piperazine
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Frequently Asked Questions

What is the IUPAC name of 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]piperazine?
The IUPAC name of 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]piperazine (CID 82611840) is 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]piperazine.
What is the SMILES notation for 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]piperazine?
The canonical SMILES for 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]piperazine is Cc1nn(C)cc1CCN1CCNCC1.
What is the InChIKey of 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]piperazine?
The InChIKey is OQSOMTJTPXKKSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-10-11(9-14(2)13-10)3-6-15-7-4-12-5-8-15/h9,12H,3-8H2,1-2H3.
What are the key properties of 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]piperazine?
1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]piperazine has a molecular weight of 208.31 g/mol, XLogP of 0.18, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]piperazine is sourced from PubChem (CID 82611840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).