(Z)-2-(1-ethyl-4-methylpiperazin-2-yl)-3-methyliminoprop-1-en-1-amine

C11H22N4 — CID 177189009

IUPAC(Z)-2-(1-ethyl-4-methylpiperazin-2-yl)-3-methyliminoprop-1-en-1-amine
SMILESCCN1CCN(C)CC1C(=C/N)/C=N/C
InChIInChI=1S/C11H22N4/c1-4-15-6-5-14(3)9-11(15)10(7-12)8-13-2/h7-8,11H,4-6,9,12H2,1-3H3/b10-7+,13-8+
InChIKeyAGSCZGPZZSPQGE-OOHIBURESA-N
MW210.32 g/mol
LogP0.17
Rot. Bonds3

About (Z)-2-(1-ethyl-4-methylpiperazin-2-yl)-3-methyliminoprop-1-en-1-amine

(Z)-2-(1-ethyl-4-methylpiperazin-2-yl)-3-methyliminoprop-1-en-1-amine (PubChem CID 177189009) has the molecular formula C11H22N4 and a molecular weight of 210.32 g/mol. Its IUPAC name is (Z)-2-(1-ethyl-4-methylpiperazin-2-yl)-3-methyliminoprop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-2-(1-ethyl-4-methylpiperazin-2-yl)-3-methyliminoprop-1-en-1-amine
PubChem CID177189009
Molecular FormulaC11H22N4
Molecular Weight210.32 g/mol
Exact Mass210.18
IUPAC Name(Z)-2-(1-ethyl-4-methylpiperazin-2-yl)-3-methyliminoprop-1-en-1-amine
SMILESCCN1CCN(C)CC1C(=C/N)/C=N/C
InChIInChI=1S/C11H22N4/c1-4-15-6-5-14(3)9-11(15)10(7-12)8-13-2/h7-8,11H,4-6,9,12H2,1-3H3/b10-7+,13-8+
InChIKeyAGSCZGPZZSPQGE-OOHIBURESA-N
XLogP0.17
TPSA44.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (Z)-2-(1-ethyl-4-methylpiperazin-2-yl)-3-methyliminoprop-1-en-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (Z)-2-(1-ethyl-4-methylpiperazin-2-yl)-3-methyliminoprop-1-en-1-amine?
The IUPAC name of (Z)-2-(1-ethyl-4-methylpiperazin-2-yl)-3-methyliminoprop-1-en-1-amine (CID 177189009) is (Z)-2-(1-ethyl-4-methylpiperazin-2-yl)-3-methyliminoprop-1-en-1-amine.
What is the SMILES notation for (Z)-2-(1-ethyl-4-methylpiperazin-2-yl)-3-methyliminoprop-1-en-1-amine?
The canonical SMILES for (Z)-2-(1-ethyl-4-methylpiperazin-2-yl)-3-methyliminoprop-1-en-1-amine is CCN1CCN(C)CC1C(=C/N)/C=N/C.
What is the InChIKey of (Z)-2-(1-ethyl-4-methylpiperazin-2-yl)-3-methyliminoprop-1-en-1-amine?
The InChIKey is AGSCZGPZZSPQGE-OOHIBURESA-N. The full InChI is InChI=1S/C11H22N4/c1-4-15-6-5-14(3)9-11(15)10(7-12)8-13-2/h7-8,11H,4-6,9,12H2,1-3H3/b10-7+,13-8+.
What are the key properties of (Z)-2-(1-ethyl-4-methylpiperazin-2-yl)-3-methyliminoprop-1-en-1-amine?
(Z)-2-(1-ethyl-4-methylpiperazin-2-yl)-3-methyliminoprop-1-en-1-amine has a molecular weight of 210.32 g/mol, XLogP of 0.17, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-(1-ethyl-4-methylpiperazin-2-yl)-3-methyliminoprop-1-en-1-amine is sourced from PubChem (CID 177189009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).