1-(1-methylcyclopropyl)piperazine

C8H16N2 — CID 18770871

IUPAC1-(1-methylcyclopropyl)piperazine
SMILESCC1(N2CCNCC2)CC1
InChIInChI=1S/C8H16N2/c1-8(2-3-8)10-6-4-9-5-7-10/h9H,2-7H2,1H3
InChIKeyJEXCKZNACNENIV-UHFFFAOYSA-N
MW140.23 g/mol
LogP0.44
Rot. Bonds1

About 1-(1-methylcyclopropyl)piperazine

1-(1-methylcyclopropyl)piperazine (PubChem CID 18770871) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 1-(1-methylcyclopropyl)piperazine.

Molecular Properties

Compound Name1-(1-methylcyclopropyl)piperazine
PubChem CID18770871
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name1-(1-methylcyclopropyl)piperazine
SMILESCC1(N2CCNCC2)CC1
InChIInChI=1S/C8H16N2/c1-8(2-3-8)10-6-4-9-5-7-10/h9H,2-7H2,1H3
InChIKeyJEXCKZNACNENIV-UHFFFAOYSA-N
XLogP0.44
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methylcyclopropyl)piperazine?
The IUPAC name of 1-(1-methylcyclopropyl)piperazine (CID 18770871) is 1-(1-methylcyclopropyl)piperazine.
What is the SMILES notation for 1-(1-methylcyclopropyl)piperazine?
The canonical SMILES for 1-(1-methylcyclopropyl)piperazine is CC1(N2CCNCC2)CC1.
What is the InChIKey of 1-(1-methylcyclopropyl)piperazine?
The InChIKey is JEXCKZNACNENIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-8(2-3-8)10-6-4-9-5-7-10/h9H,2-7H2,1H3.
What are the key properties of 1-(1-methylcyclopropyl)piperazine?
1-(1-methylcyclopropyl)piperazine has a molecular weight of 140.23 g/mol, XLogP of 0.44, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylcyclopropyl)piperazine is sourced from PubChem (CID 18770871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).