1-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]piperazine

C11H18N4 — CID 62488170

IUPAC1-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]piperazine
SMILESc1c(C2CC2)n[nH]c1CN1CCNCC1
InChIInChI=1S/C11H18N4/c1-2-9(1)11-7-10(13-14-11)8-15-5-3-12-4-6-15/h7,9,12H,1-6,8H2,(H,13,14)
InChIKeySRZDAVUPBIKAQD-UHFFFAOYSA-N
MW206.29 g/mol
LogP0.69
Rot. Bonds3

About 1-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]piperazine

1-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]piperazine (PubChem CID 62488170) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 1-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]piperazine.

Molecular Properties

Compound Name1-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]piperazine
PubChem CID62488170
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name1-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]piperazine
SMILESc1c(C2CC2)n[nH]c1CN1CCNCC1
InChIInChI=1S/C11H18N4/c1-2-9(1)11-7-10(13-14-11)8-15-5-3-12-4-6-15/h7,9,12H,1-6,8H2,(H,13,14)
InChIKeySRZDAVUPBIKAQD-UHFFFAOYSA-N
XLogP0.69
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]piperazine?
The IUPAC name of 1-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]piperazine (CID 62488170) is 1-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]piperazine.
What is the SMILES notation for 1-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]piperazine?
The canonical SMILES for 1-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]piperazine is c1c(C2CC2)n[nH]c1CN1CCNCC1.
What is the InChIKey of 1-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]piperazine?
The InChIKey is SRZDAVUPBIKAQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-2-9(1)11-7-10(13-14-11)8-15-5-3-12-4-6-15/h7,9,12H,1-6,8H2,(H,13,14).
What are the key properties of 1-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]piperazine?
1-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]piperazine has a molecular weight of 206.29 g/mol, XLogP of 0.69, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]piperazine is sourced from PubChem (CID 62488170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).