2-cyclopropyl-1-methylpiperazine

C8H16N2 — CID 54518089

IUPAC2-cyclopropyl-1-methylpiperazine
SMILESCN1CCNCC1C1CC1
InChIInChI=1S/C8H16N2/c1-10-5-4-9-6-8(10)7-2-3-7/h7-9H,2-6H2,1H3
InChIKeyYNVCEIJDTGJKRB-UHFFFAOYSA-N
MW140.23 g/mol
LogP0.30
Rot. Bonds1

About 2-cyclopropyl-1-methylpiperazine

2-cyclopropyl-1-methylpiperazine (PubChem CID 54518089) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 2-cyclopropyl-1-methylpiperazine.

Molecular Properties

Compound Name2-cyclopropyl-1-methylpiperazine
PubChem CID54518089
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name2-cyclopropyl-1-methylpiperazine
SMILESCN1CCNCC1C1CC1
InChIInChI=1S/C8H16N2/c1-10-5-4-9-6-8(10)7-2-3-7/h7-9H,2-6H2,1H3
InChIKeyYNVCEIJDTGJKRB-UHFFFAOYSA-N
XLogP0.30
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 ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-methylpiperazine?
The IUPAC name of 2-cyclopropyl-1-methylpiperazine (CID 54518089) is 2-cyclopropyl-1-methylpiperazine.
What is the SMILES notation for 2-cyclopropyl-1-methylpiperazine?
The canonical SMILES for 2-cyclopropyl-1-methylpiperazine is CN1CCNCC1C1CC1.
What is the InChIKey of 2-cyclopropyl-1-methylpiperazine?
The InChIKey is YNVCEIJDTGJKRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-10-5-4-9-6-8(10)7-2-3-7/h7-9H,2-6H2,1H3.
What are the key properties of 2-cyclopropyl-1-methylpiperazine?
2-cyclopropyl-1-methylpiperazine has a molecular weight of 140.23 g/mol, XLogP of 0.30, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-methylpiperazine is sourced from PubChem (CID 54518089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).