(Z)-N-[(E)-2-piperidin-4-ylprop-1-enyl]pent-3-en-2-imine

C13H22N2 — CID 143841174

IUPAC(Z)-N-[(E)-2-piperidin-4-ylprop-1-enyl]pent-3-en-2-imine
SMILESC/C=C\C(C)=N\C=C(/C)C1CCNCC1
InChIInChI=1S/C13H22N2/c1-4-5-12(3)15-10-11(2)13-6-8-14-9-7-13/h4-5,10,13-14H,6-9H2,1-3H3/b5-4-,11-10+,15-12+
InChIKeyKUZINGQSYOWINA-JLSFJDPMSA-N
MW206.33 g/mol
LogP2.93
Rot. Bonds3

About (Z)-N-[(E)-2-piperidin-4-ylprop-1-enyl]pent-3-en-2-imine

(Z)-N-[(E)-2-piperidin-4-ylprop-1-enyl]pent-3-en-2-imine (PubChem CID 143841174) has the molecular formula C13H22N2 and a molecular weight of 206.33 g/mol. Its IUPAC name is (Z)-N-[(E)-2-piperidin-4-ylprop-1-enyl]pent-3-en-2-imine.

Molecular Properties

Compound Name(Z)-N-[(E)-2-piperidin-4-ylprop-1-enyl]pent-3-en-2-imine
PubChem CID143841174
Molecular FormulaC13H22N2
Molecular Weight206.33 g/mol
Exact Mass206.18
IUPAC Name(Z)-N-[(E)-2-piperidin-4-ylprop-1-enyl]pent-3-en-2-imine
SMILESC/C=C\C(C)=N\C=C(/C)C1CCNCC1
InChIInChI=1S/C13H22N2/c1-4-5-12(3)15-10-11(2)13-6-8-14-9-7-13/h4-5,10,13-14H,6-9H2,1-3H3/b5-4-,11-10+,15-12+
InChIKeyKUZINGQSYOWINA-JLSFJDPMSA-N
XLogP2.93
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(4Z)-4-(2-fluorobutylidene)-N-methylpiperidin-3-imine
CID 123919585
4-(5-methyl-2H-pyrrol-3-yl)piperidine
CID 58578256
4-methanidylpiperidine;5-methyl-2H-pyridin-2-ide;yttrium
CID 59718538
6-Methyl-3-(piperidin-4-ylmethyl)-2,3-dihydropyridine
CID 91582344
(E)-4-piperidin-4-ylpent-3-en-2-imine
CID 123268672
7-ethyl-5-(2-piperidin-4-ylethyl)-4H-azepine
CID 123370701
(E)-4-piperidin-3-ylpent-3-en-2-imine
CID 123503371
(5Z)-7-piperidin-3-ylocta-5,7-dien-4-imine
CID 123845307
N-(piperidin-4-ylmethyl)but-3-en-2-imine
CID 123852038
5,10-Dimethyl-1,2,3,4,8,9-hexahydropyrido[3,2-b]azocin-5-ium
CID 123870333
(E)-2-ethyl-3-methyl-4-[(6-methyl-2-methylidene-3-pyridinylidene)amino]but-3-en-1-amine
CID 135160857
1-piperidin-4-yl-N-[(E)-prop-1-enyl]prop-2-en-1-imine
CID 141203200

Frequently Asked Questions

What is the IUPAC name of (Z)-N-[(E)-2-piperidin-4-ylprop-1-enyl]pent-3-en-2-imine?
The IUPAC name of (Z)-N-[(E)-2-piperidin-4-ylprop-1-enyl]pent-3-en-2-imine (CID 143841174) is (Z)-N-[(E)-2-piperidin-4-ylprop-1-enyl]pent-3-en-2-imine.
What is the SMILES notation for (Z)-N-[(E)-2-piperidin-4-ylprop-1-enyl]pent-3-en-2-imine?
The canonical SMILES for (Z)-N-[(E)-2-piperidin-4-ylprop-1-enyl]pent-3-en-2-imine is C/C=C\C(C)=N\C=C(/C)C1CCNCC1.
What is the InChIKey of (Z)-N-[(E)-2-piperidin-4-ylprop-1-enyl]pent-3-en-2-imine?
The InChIKey is KUZINGQSYOWINA-JLSFJDPMSA-N. The full InChI is InChI=1S/C13H22N2/c1-4-5-12(3)15-10-11(2)13-6-8-14-9-7-13/h4-5,10,13-14H,6-9H2,1-3H3/b5-4-,11-10+,15-12+.
What are the key properties of (Z)-N-[(E)-2-piperidin-4-ylprop-1-enyl]pent-3-en-2-imine?
(Z)-N-[(E)-2-piperidin-4-ylprop-1-enyl]pent-3-en-2-imine has a molecular weight of 206.33 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-[(E)-2-piperidin-4-ylprop-1-enyl]pent-3-en-2-imine is sourced from PubChem (CID 143841174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).