(Z)-4-piperidin-2-ylbut-3-en-1-amine

C9H18N2 — CID 117267610

IUPAC(Z)-4-piperidin-2-ylbut-3-en-1-amine
SMILESNCC/C=C\C1CCCCN1
InChIInChI=1S/C9H18N2/c10-7-3-1-5-9-6-2-4-8-11-9/h1,5,9,11H,2-4,6-8,10H2/b5-1-
InChIKeyMBCXZGXLPKHWER-KTAJNNJTSA-N
MW154.26 g/mol
LogP1.03
Rot. Bonds3

About (Z)-4-piperidin-2-ylbut-3-en-1-amine

(Z)-4-piperidin-2-ylbut-3-en-1-amine (PubChem CID 117267610) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is (Z)-4-piperidin-2-ylbut-3-en-1-amine.

Molecular Properties

Compound Name(Z)-4-piperidin-2-ylbut-3-en-1-amine
PubChem CID117267610
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name(Z)-4-piperidin-2-ylbut-3-en-1-amine
SMILESNCC/C=C\C1CCCCN1
InChIInChI=1S/C9H18N2/c10-7-3-1-5-9-6-2-4-8-11-9/h1,5,9,11H,2-4,6-8,10H2/b5-1-
InChIKeyMBCXZGXLPKHWER-KTAJNNJTSA-N
XLogP1.03
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(Z)-4-pyrrolidin-2-ylbut-3-en-1-amine
CID 117267558
2-[(Z)-pent-1-enyl]pyrrolidine
CID 55300671
ethyl (E)-4-pyrrolidin-2-ylbut-3-enoate
CID 126845658
2-ethenylazonane
CID 139338829
(2R)-piperidine-2-carbaldehyde;hydrochloride
CID 131884313
5-amino-2-piperidin-2-ylpentanal
CID 171815002
azepan-2-ylmethanimine
CID 88721804
(NZ)-N-(piperidin-2-ylmethylidene)hydroxylamine
CID 6332583
(2R)-2-[(Z)-2-phenylethenyl]azepane
CID 97289892
2-[(E)-2-(2-fluorophenyl)ethenyl]azocane
CID 114239682
2-[(E)-2-(2-fluorophenyl)ethenyl]piperidine;hydrochloride
CID 126844744
2-(4-chlorophenyl)-2-piperidin-2-ylethanamine
CID 83986370

Frequently Asked Questions

What is the IUPAC name of (Z)-4-piperidin-2-ylbut-3-en-1-amine?
The IUPAC name of (Z)-4-piperidin-2-ylbut-3-en-1-amine (CID 117267610) is (Z)-4-piperidin-2-ylbut-3-en-1-amine.
What is the SMILES notation for (Z)-4-piperidin-2-ylbut-3-en-1-amine?
The canonical SMILES for (Z)-4-piperidin-2-ylbut-3-en-1-amine is NCC/C=C\C1CCCCN1.
What is the InChIKey of (Z)-4-piperidin-2-ylbut-3-en-1-amine?
The InChIKey is MBCXZGXLPKHWER-KTAJNNJTSA-N. The full InChI is InChI=1S/C9H18N2/c10-7-3-1-5-9-6-2-4-8-11-9/h1,5,9,11H,2-4,6-8,10H2/b5-1-.
What are the key properties of (Z)-4-piperidin-2-ylbut-3-en-1-amine?
(Z)-4-piperidin-2-ylbut-3-en-1-amine has a molecular weight of 154.26 g/mol, XLogP of 1.03, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-piperidin-2-ylbut-3-en-1-amine is sourced from PubChem (CID 117267610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).