1-piperazin-1-yl-N-[(Z)-prop-1-enyl]prop-2-en-1-imine

C10H17N3 — CID 143698770

IUPAC1-piperazin-1-yl-N-[(Z)-prop-1-enyl]prop-2-en-1-imine
SMILESC=C/C(=N\C=C/C)N1CCNCC1
InChIInChI=1S/C10H17N3/c1-3-5-12-10(4-2)13-8-6-11-7-9-13/h3-5,11H,2,6-9H2,1H3/b5-3-,12-10+
InChIKeyIFOADBWXPFODHT-XIIBSCIISA-N
MW179.27 g/mol
LogP1.01
Rot. Bonds2

About 1-piperazin-1-yl-N-[(Z)-prop-1-enyl]prop-2-en-1-imine

1-piperazin-1-yl-N-[(Z)-prop-1-enyl]prop-2-en-1-imine (PubChem CID 143698770) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 1-piperazin-1-yl-N-[(Z)-prop-1-enyl]prop-2-en-1-imine.

Molecular Properties

Compound Name1-piperazin-1-yl-N-[(Z)-prop-1-enyl]prop-2-en-1-imine
PubChem CID143698770
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name1-piperazin-1-yl-N-[(Z)-prop-1-enyl]prop-2-en-1-imine
SMILESC=C/C(=N\C=C/C)N1CCNCC1
InChIInChI=1S/C10H17N3/c1-3-5-12-10(4-2)13-8-6-11-7-9-13/h3-5,11H,2,6-9H2,1H3/b5-3-,12-10+
InChIKeyIFOADBWXPFODHT-XIIBSCIISA-N
XLogP1.01
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

7-piperazin-1-yl-4H-azepine
CID 54476477
(E)-N-(1-fluoroethenyl)-1-piperazin-1-ylprop-2-en-1-imine
CID 144288809
2-[4-[(E)-C-ethenyl-N-(1-fluoroethenyl)carbonimidoyl]piperazin-1-yl]ethanamine
CID 144288885
2,3-bis(prop-1-enyl)-4,5-dihydro-1H-imidazol-3-ium
CID 57177363
(Z)-N-ethenyl-1-piperazin-1-ylbut-2-en-1-imine
CID 67557751
(Z)-2-(1-piperazin-1-ylprop-2-enylideneamino)ethenamine
CID 69914758
1-(4-methylpiperazin-1-yl)-N-[(Z)-prop-1-enyl]prop-2-en-1-imine
CID 70293948
N-[(1Z)-buta-1,3-dienyl]-1-piperazin-1-ylethanimine
CID 89117793
(Z)-4-ethenylimino-4-(4-methylpiperazin-1-yl)but-2-en-2-amine
CID 89881701
1-(4-methylpiperazin-1-yl)-N-[(Z)-prop-1-enyl]ethanimine
CID 90250320
1-piperazin-1-yl-N-[(E)-prop-1-enyl]methanimine
CID 118489766
(Z)-N-ethenyl-3-iodo-1-piperazin-1-ylprop-2-en-1-imine
CID 121257398

Frequently Asked Questions

What is the IUPAC name of 1-piperazin-1-yl-N-[(Z)-prop-1-enyl]prop-2-en-1-imine?
The IUPAC name of 1-piperazin-1-yl-N-[(Z)-prop-1-enyl]prop-2-en-1-imine (CID 143698770) is 1-piperazin-1-yl-N-[(Z)-prop-1-enyl]prop-2-en-1-imine.
What is the SMILES notation for 1-piperazin-1-yl-N-[(Z)-prop-1-enyl]prop-2-en-1-imine?
The canonical SMILES for 1-piperazin-1-yl-N-[(Z)-prop-1-enyl]prop-2-en-1-imine is C=C/C(=N\C=C/C)N1CCNCC1.
What is the InChIKey of 1-piperazin-1-yl-N-[(Z)-prop-1-enyl]prop-2-en-1-imine?
The InChIKey is IFOADBWXPFODHT-XIIBSCIISA-N. The full InChI is InChI=1S/C10H17N3/c1-3-5-12-10(4-2)13-8-6-11-7-9-13/h3-5,11H,2,6-9H2,1H3/b5-3-,12-10+.
What are the key properties of 1-piperazin-1-yl-N-[(Z)-prop-1-enyl]prop-2-en-1-imine?
1-piperazin-1-yl-N-[(Z)-prop-1-enyl]prop-2-en-1-imine has a molecular weight of 179.27 g/mol, XLogP of 1.01, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperazin-1-yl-N-[(Z)-prop-1-enyl]prop-2-en-1-imine is sourced from PubChem (CID 143698770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).