1-(cyclopropylmethyl)piperazine

C8H16N2 — CID 965875

IUPAC1-(cyclopropylmethyl)piperazine
SMILESC1CN(CC2CC2)CCN1
InChIInChI=1S/C8H16N2/c1-2-8(1)7-10-5-3-9-4-6-10/h8-9H,1-7H2
InChIKeyIVLIBVDZIYFXBZ-UHFFFAOYSA-N
MW140.23 g/mol
LogP0.30
Rot. Bonds2

About 1-(cyclopropylmethyl)piperazine

1-(cyclopropylmethyl)piperazine (PubChem CID 965875) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)piperazine.

Molecular Properties

Compound Name1-(cyclopropylmethyl)piperazine
PubChem CID965875
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name1-(cyclopropylmethyl)piperazine
SMILESC1CN(CC2CC2)CCN1
InChIInChI=1S/C8H16N2/c1-2-8(1)7-10-5-3-9-4-6-10/h8-9H,1-7H2
InChIKeyIVLIBVDZIYFXBZ-UHFFFAOYSA-N
XLogP0.30
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)piperazine?
The IUPAC name of 1-(cyclopropylmethyl)piperazine (CID 965875) is 1-(cyclopropylmethyl)piperazine.
What is the SMILES notation for 1-(cyclopropylmethyl)piperazine?
The canonical SMILES for 1-(cyclopropylmethyl)piperazine is C1CN(CC2CC2)CCN1.
What is the InChIKey of 1-(cyclopropylmethyl)piperazine?
The InChIKey is IVLIBVDZIYFXBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-2-8(1)7-10-5-3-9-4-6-10/h8-9H,1-7H2.
What are the key properties of 1-(cyclopropylmethyl)piperazine?
1-(cyclopropylmethyl)piperazine has a molecular weight of 140.23 g/mol, XLogP of 0.30, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)piperazine is sourced from PubChem (CID 965875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).