1-(1H-imidazol-2-yl)piperazine

C7H12N4 — CID 22361242

IUPAC1-(1H-imidazol-2-yl)piperazine
SMILESc1c[nH]c(N2CCNCC2)n1
InChIInChI=1S/C7H12N4/c1-2-10-7(9-1)11-5-3-8-4-6-11/h1-2,8H,3-6H2,(H,9,10)
InChIKeyMHMOUFDAKNJXSK-UHFFFAOYSA-N
MW152.20 g/mol
LogP-0.18
Rot. Bonds1

About 1-(1H-imidazol-2-yl)piperazine

1-(1H-imidazol-2-yl)piperazine (PubChem CID 22361242) has the molecular formula C7H12N4 and a molecular weight of 152.20 g/mol. Its IUPAC name is 1-(1H-imidazol-2-yl)piperazine.

Molecular Properties

Compound Name1-(1H-imidazol-2-yl)piperazine
PubChem CID22361242
Molecular FormulaC7H12N4
Molecular Weight152.20 g/mol
Exact Mass152.11
IUPAC Name1-(1H-imidazol-2-yl)piperazine
SMILESc1c[nH]c(N2CCNCC2)n1
InChIInChI=1S/C7H12N4/c1-2-10-7(9-1)11-5-3-8-4-6-11/h1-2,8H,3-6H2,(H,9,10)
InChIKeyMHMOUFDAKNJXSK-UHFFFAOYSA-N
XLogP-0.18
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1H-imidazol-2-yl)piperazine?
The IUPAC name of 1-(1H-imidazol-2-yl)piperazine (CID 22361242) is 1-(1H-imidazol-2-yl)piperazine.
What is the SMILES notation for 1-(1H-imidazol-2-yl)piperazine?
The canonical SMILES for 1-(1H-imidazol-2-yl)piperazine is c1c[nH]c(N2CCNCC2)n1.
What is the InChIKey of 1-(1H-imidazol-2-yl)piperazine?
The InChIKey is MHMOUFDAKNJXSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4/c1-2-10-7(9-1)11-5-3-8-4-6-11/h1-2,8H,3-6H2,(H,9,10).
What are the key properties of 1-(1H-imidazol-2-yl)piperazine?
1-(1H-imidazol-2-yl)piperazine has a molecular weight of 152.20 g/mol, XLogP of -0.18, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-imidazol-2-yl)piperazine is sourced from PubChem (CID 22361242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).