1-ethyl-3-methylidenepiperazine

C7H14N2 — CID 22980279

IUPAC1-ethyl-3-methylidenepiperazine
SMILESC=C1CN(CC)CCN1
InChIInChI=1S/C7H14N2/c1-3-9-5-4-8-7(2)6-9/h8H,2-6H2,1H3
InChIKeyQEUPFVFNUUCXGM-UHFFFAOYSA-N
MW126.20 g/mol
LogP0.43
Rot. Bonds1

About 1-ethyl-3-methylidenepiperazine

1-ethyl-3-methylidenepiperazine (PubChem CID 22980279) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is 1-ethyl-3-methylidenepiperazine.

Molecular Properties

Compound Name1-ethyl-3-methylidenepiperazine
PubChem CID22980279
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Name1-ethyl-3-methylidenepiperazine
SMILESC=C1CN(CC)CCN1
InChIInChI=1S/C7H14N2/c1-3-9-5-4-8-7(2)6-9/h8H,2-6H2,1H3
InChIKeyQEUPFVFNUUCXGM-UHFFFAOYSA-N
XLogP0.43
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-methylidenepiperazine?
The IUPAC name of 1-ethyl-3-methylidenepiperazine (CID 22980279) is 1-ethyl-3-methylidenepiperazine.
What is the SMILES notation for 1-ethyl-3-methylidenepiperazine?
The canonical SMILES for 1-ethyl-3-methylidenepiperazine is C=C1CN(CC)CCN1.
What is the InChIKey of 1-ethyl-3-methylidenepiperazine?
The InChIKey is QEUPFVFNUUCXGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2/c1-3-9-5-4-8-7(2)6-9/h8H,2-6H2,1H3.
What are the key properties of 1-ethyl-3-methylidenepiperazine?
1-ethyl-3-methylidenepiperazine has a molecular weight of 126.20 g/mol, XLogP of 0.43, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-methylidenepiperazine is sourced from PubChem (CID 22980279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).