1-(1-cyclopropylethyl)piperazine

C9H18N2 — CID 46785874

IUPAC1-(1-cyclopropylethyl)piperazine
SMILESCC(C1CC1)N1CCNCC1
InChIInChI=1S/C9H18N2/c1-8(9-2-3-9)11-6-4-10-5-7-11/h8-10H,2-7H2,1H3
InChIKeyAXJIJAULSKAVAR-UHFFFAOYSA-N
MW154.26 g/mol
LogP0.69
Rot. Bonds2

About 1-(1-cyclopropylethyl)piperazine

1-(1-cyclopropylethyl)piperazine (PubChem CID 46785874) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 1-(1-cyclopropylethyl)piperazine.

Molecular Properties

Compound Name1-(1-cyclopropylethyl)piperazine
PubChem CID46785874
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name1-(1-cyclopropylethyl)piperazine
SMILESCC(C1CC1)N1CCNCC1
InChIInChI=1S/C9H18N2/c1-8(9-2-3-9)11-6-4-10-5-7-11/h8-10H,2-7H2,1H3
InChIKeyAXJIJAULSKAVAR-UHFFFAOYSA-N
XLogP0.69
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopropylethyl)piperazine?
The IUPAC name of 1-(1-cyclopropylethyl)piperazine (CID 46785874) is 1-(1-cyclopropylethyl)piperazine.
What is the SMILES notation for 1-(1-cyclopropylethyl)piperazine?
The canonical SMILES for 1-(1-cyclopropylethyl)piperazine is CC(C1CC1)N1CCNCC1.
What is the InChIKey of 1-(1-cyclopropylethyl)piperazine?
The InChIKey is AXJIJAULSKAVAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-8(9-2-3-9)11-6-4-10-5-7-11/h8-10H,2-7H2,1H3.
What are the key properties of 1-(1-cyclopropylethyl)piperazine?
1-(1-cyclopropylethyl)piperazine has a molecular weight of 154.26 g/mol, XLogP of 0.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopropylethyl)piperazine is sourced from PubChem (CID 46785874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).