(E)-N-(4-methylpiperazin-1-yl)ethanimine

C7H15N3 — CID 18726847

IUPAC(E)-N-(4-methylpiperazin-1-yl)ethanimine
SMILESC/C=N/N1CCN(C)CC1
InChIInChI=1S/C7H15N3/c1-3-8-10-6-4-9(2)5-7-10/h3H,4-7H2,1-2H3/b8-3+
InChIKeyPBLVNWLNRWMMEA-FPYGCLRLSA-N
MW141.22 g/mol
LogP0.24
Rot. Bonds1

About (E)-N-(4-methylpiperazin-1-yl)ethanimine

(E)-N-(4-methylpiperazin-1-yl)ethanimine (PubChem CID 18726847) has the molecular formula C7H15N3 and a molecular weight of 141.22 g/mol. Its IUPAC name is (E)-N-(4-methylpiperazin-1-yl)ethanimine.

Molecular Properties

Compound Name(E)-N-(4-methylpiperazin-1-yl)ethanimine
PubChem CID18726847
Molecular FormulaC7H15N3
Molecular Weight141.22 g/mol
Exact Mass141.13
IUPAC Name(E)-N-(4-methylpiperazin-1-yl)ethanimine
SMILESC/C=N/N1CCN(C)CC1
InChIInChI=1S/C7H15N3/c1-3-8-10-6-4-9(2)5-7-10/h3H,4-7H2,1-2H3/b8-3+
InChIKeyPBLVNWLNRWMMEA-FPYGCLRLSA-N
XLogP0.24
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.22
LogP ≤ 50.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

ethane;N-(4-methylpiperazin-1-yl)ethanimine
CID 53996455
N-(4-methylpiperazin-1-yl)methanimine
CID 54113862
(E)-N-(4-propylpiperazin-1-yl)ethanimine
CID 57950808
(E)-N-(4-prop-2-ynylpiperazin-1-yl)ethanimine
CID 57950850
(Z)-N-(4-methylpiperazin-1-yl)ethanimine
CID 67990822
(Z)-N-(4-propylpiperazin-1-yl)ethanimine
CID 90836574
(Z)-N-(4-prop-2-ynylpiperazin-1-yl)ethanimine
CID 90942989
(E)-N-(4-methylpiperazin-1-yl)propan-1-imine
CID 153348561
(E)-N-(4-ethylpiperazin-1-yl)propan-1-imine
CID 155155153
N-(4-ethylpiperazin-1-yl)methanimine
CID 155155174
(E)-N-(4-ethylpiperazin-1-yl)ethanimine
CID 155157797
N-(4-methylpiperazin-1-yl)ethanimine
CID 53996456

Frequently Asked Questions

What is the IUPAC name of (E)-N-(4-methylpiperazin-1-yl)ethanimine?
The IUPAC name of (E)-N-(4-methylpiperazin-1-yl)ethanimine (CID 18726847) is (E)-N-(4-methylpiperazin-1-yl)ethanimine.
What is the SMILES notation for (E)-N-(4-methylpiperazin-1-yl)ethanimine?
The canonical SMILES for (E)-N-(4-methylpiperazin-1-yl)ethanimine is C/C=N/N1CCN(C)CC1.
What is the InChIKey of (E)-N-(4-methylpiperazin-1-yl)ethanimine?
The InChIKey is PBLVNWLNRWMMEA-FPYGCLRLSA-N. The full InChI is InChI=1S/C7H15N3/c1-3-8-10-6-4-9(2)5-7-10/h3H,4-7H2,1-2H3/b8-3+.
What are the key properties of (E)-N-(4-methylpiperazin-1-yl)ethanimine?
(E)-N-(4-methylpiperazin-1-yl)ethanimine has a molecular weight of 141.22 g/mol, XLogP of 0.24, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(4-methylpiperazin-1-yl)ethanimine is sourced from PubChem (CID 18726847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).