N-[1-(4-methylpiperazin-1-yl)ethenyl]methanimine

C8H15N3 — CID 123429548

IUPACN-[1-(4-methylpiperazin-1-yl)ethenyl]methanimine
SMILESC=NC(=C)N1CCN(C)CC1
InChIInChI=1S/C8H15N3/c1-8(9-2)11-6-4-10(3)5-7-11/h1-2,4-7H2,3H3
InChIKeyGLFBHRBXPQLQKB-UHFFFAOYSA-N
MW153.23 g/mol
LogP0.41
Rot. Bonds2

About N-[1-(4-methylpiperazin-1-yl)ethenyl]methanimine

N-[1-(4-methylpiperazin-1-yl)ethenyl]methanimine (PubChem CID 123429548) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is N-[1-(4-methylpiperazin-1-yl)ethenyl]methanimine.

Molecular Properties

Compound NameN-[1-(4-methylpiperazin-1-yl)ethenyl]methanimine
PubChem CID123429548
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC NameN-[1-(4-methylpiperazin-1-yl)ethenyl]methanimine
SMILESC=NC(=C)N1CCN(C)CC1
InChIInChI=1S/C8H15N3/c1-8(9-2)11-6-4-10(3)5-7-11/h1-2,4-7H2,3H3
InChIKeyGLFBHRBXPQLQKB-UHFFFAOYSA-N
XLogP0.41
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 50.41
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

N-[(4-methylpiperazin-1-yl)methyl]methanimine
CID 91606147
(Z)-N-[(Z)-2-(methylideneamino)-1-(4-methylpiperazin-1-yl)ethenyl]ethanimine
CID 143250349
N,N-dimethyl-1-(4-methylpiperazin-1-yl)ethenamine
CID 144151497
N,N-diethyl-1-(4-methylpiperazin-1-yl)ethenamine
CID 156145176
N-[1-(4-ethylpiperazin-1-yl)ethyl]methanimine
CID 161732121
N,N,N'-trimethyl-N'-[1-(methylideneamino)ethenyl]ethane-1,2-diamine
CID 163794272
N-[1-[(2S)-2,4-dimethylpiperazin-1-yl]ethenyl]methanimine
CID 166869661
N-[1-(3,3,4-trimethylpiperazin-1-yl)ethenyl]methanimine
CID 166870791
(Z)-N-[1-(4-methylpiperazin-1-yl)ethenyl]propan-1-imine
CID 144179565

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methylpiperazin-1-yl)ethenyl]methanimine?
The IUPAC name of N-[1-(4-methylpiperazin-1-yl)ethenyl]methanimine (CID 123429548) is N-[1-(4-methylpiperazin-1-yl)ethenyl]methanimine.
What is the SMILES notation for N-[1-(4-methylpiperazin-1-yl)ethenyl]methanimine?
The canonical SMILES for N-[1-(4-methylpiperazin-1-yl)ethenyl]methanimine is C=NC(=C)N1CCN(C)CC1.
What is the InChIKey of N-[1-(4-methylpiperazin-1-yl)ethenyl]methanimine?
The InChIKey is GLFBHRBXPQLQKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-8(9-2)11-6-4-10(3)5-7-11/h1-2,4-7H2,3H3.
What are the key properties of N-[1-(4-methylpiperazin-1-yl)ethenyl]methanimine?
N-[1-(4-methylpiperazin-1-yl)ethenyl]methanimine has a molecular weight of 153.23 g/mol, XLogP of 0.41, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methylpiperazin-1-yl)ethenyl]methanimine is sourced from PubChem (CID 123429548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).