(Z)-N-ethyl-2-piperidin-2-ylhex-4-en-3-imine

C13H24N2 — CID 144549902

IUPAC(Z)-N-ethyl-2-piperidin-2-ylhex-4-en-3-imine
SMILESC/C=C\C(=N/CC)C(C)C1CCCCN1
InChIInChI=1S/C13H24N2/c1-4-8-12(14-5-2)11(3)13-9-6-7-10-15-13/h4,8,11,13,15H,5-7,9-10H2,1-3H3/b8-4-,14-12+
InChIKeyPGBCAWSHKWQJOD-WULPCOFFSA-N
MW208.35 g/mol
LogP2.80
Rot. Bonds4

About (Z)-N-ethyl-2-piperidin-2-ylhex-4-en-3-imine

(Z)-N-ethyl-2-piperidin-2-ylhex-4-en-3-imine (PubChem CID 144549902) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is (Z)-N-ethyl-2-piperidin-2-ylhex-4-en-3-imine.

Molecular Properties

Compound Name(Z)-N-ethyl-2-piperidin-2-ylhex-4-en-3-imine
PubChem CID144549902
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name(Z)-N-ethyl-2-piperidin-2-ylhex-4-en-3-imine
SMILESC/C=C\C(=N/CC)C(C)C1CCCCN1
InChIInChI=1S/C13H24N2/c1-4-8-12(14-5-2)11(3)13-9-6-7-10-15-13/h4,8,11,13,15H,5-7,9-10H2,1-3H3/b8-4-,14-12+
InChIKeyPGBCAWSHKWQJOD-WULPCOFFSA-N
XLogP2.80
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 52.80
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

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CID 130491233
(2S)-N-methyl-2-[(2S)-piperidin-2-yl]propanamide
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(2R)-2-butan-2-ylpiperidine
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(2S)-2-propan-2-ylpiperidine
CID 7022854
2-(1-piperidin-2-ylethyl)piperidine
CID 19900914
(2S)-2-pentan-3-ylpiperidine
CID 7048107
2-pentan-3-ylpiperidine
CID 4527381
benzene;ethane;1-piperidin-2-ylethanol;propane
CID 155698594
(2R)-2-propan-2-ylazepane
CID 7048221
ethane;2-propan-2-ylpiperidine
CID 154671868
ethyl 2-pyrrolidin-2-ylpropanoate
CID 12896133
(Z)-1-ethoxy-N-methyl-1-piperidin-2-ylhex-3-en-2-imine
CID 144549816

Frequently Asked Questions

What is the IUPAC name of (Z)-N-ethyl-2-piperidin-2-ylhex-4-en-3-imine?
The IUPAC name of (Z)-N-ethyl-2-piperidin-2-ylhex-4-en-3-imine (CID 144549902) is (Z)-N-ethyl-2-piperidin-2-ylhex-4-en-3-imine.
What is the SMILES notation for (Z)-N-ethyl-2-piperidin-2-ylhex-4-en-3-imine?
The canonical SMILES for (Z)-N-ethyl-2-piperidin-2-ylhex-4-en-3-imine is C/C=C\C(=N/CC)C(C)C1CCCCN1.
What is the InChIKey of (Z)-N-ethyl-2-piperidin-2-ylhex-4-en-3-imine?
The InChIKey is PGBCAWSHKWQJOD-WULPCOFFSA-N. The full InChI is InChI=1S/C13H24N2/c1-4-8-12(14-5-2)11(3)13-9-6-7-10-15-13/h4,8,11,13,15H,5-7,9-10H2,1-3H3/b8-4-,14-12+.
What are the key properties of (Z)-N-ethyl-2-piperidin-2-ylhex-4-en-3-imine?
(Z)-N-ethyl-2-piperidin-2-ylhex-4-en-3-imine has a molecular weight of 208.35 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-ethyl-2-piperidin-2-ylhex-4-en-3-imine is sourced from PubChem (CID 144549902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).