2-(1-benzylpiperidin-4-ylidene)ethanamine

C14H20N2 — CID 63970705

IUPAC2-(1-benzylpiperidin-4-ylidene)ethanamine
SMILESNCC=C1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C14H20N2/c15-9-6-13-7-10-16(11-8-13)12-14-4-2-1-3-5-14/h1-6H,7-12,15H2
InChIKeyGWNREMJLIDWZKG-UHFFFAOYSA-N
MW216.33 g/mol
LogP2.17
Rot. Bonds3

About 2-(1-benzylpiperidin-4-ylidene)ethanamine

2-(1-benzylpiperidin-4-ylidene)ethanamine (PubChem CID 63970705) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 2-(1-benzylpiperidin-4-ylidene)ethanamine.

Molecular Properties

Compound Name2-(1-benzylpiperidin-4-ylidene)ethanamine
PubChem CID63970705
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name2-(1-benzylpiperidin-4-ylidene)ethanamine
SMILESNCC=C1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C14H20N2/c15-9-6-13-7-10-16(11-8-13)12-14-4-2-1-3-5-14/h1-6H,7-12,15H2
InChIKeyGWNREMJLIDWZKG-UHFFFAOYSA-N
XLogP2.17
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,4,7,10-tetrabenzyl-1,4,7,10-tetrazacyclododecane
CID 160853215
ethyl 2-(1-benzylpiperidin-4-ylidene)acetate;hydrochloride
CID 13349685
1-benzylazepane
CID 10954328
dichlorocopper;1,4,7-tribenzyl-1,4,7-triazonane
CID 11307142
(1-benzyl-3,6-dihydro-2H-pyridin-4-yl)methanamine
CID 10330491
(4E)-4-(1-benzylpiperidin-3-ylidene)butan-1-amine
CID 70159543
1-benzyl-4-methylpiperazine;methanamine
CID 174694163
1-benzylpiperidin-4-one;butane
CID 70571840
1-benzyl-3-[(2-fluorophenyl)methylidene]pyrrolidine
CID 54010458
1-benzylpyrrolidine;propane
CID 143692089
1-benzyl-N-[(1R)-1-phenylethyl]piperidin-4-imine
CID 102438908
bis(copper(1+));bis(hexafluoroantimony(1-));hydrogen peroxide;bis(1,4,7-tribenzyl-1,4,7-triazonane)
CID 16687390

Frequently Asked Questions

What is the IUPAC name of 2-(1-benzylpiperidin-4-ylidene)ethanamine?
The IUPAC name of 2-(1-benzylpiperidin-4-ylidene)ethanamine (CID 63970705) is 2-(1-benzylpiperidin-4-ylidene)ethanamine.
What is the SMILES notation for 2-(1-benzylpiperidin-4-ylidene)ethanamine?
The canonical SMILES for 2-(1-benzylpiperidin-4-ylidene)ethanamine is NCC=C1CCN(Cc2ccccc2)CC1.
What is the InChIKey of 2-(1-benzylpiperidin-4-ylidene)ethanamine?
The InChIKey is GWNREMJLIDWZKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c15-9-6-13-7-10-16(11-8-13)12-14-4-2-1-3-5-14/h1-6H,7-12,15H2.
What are the key properties of 2-(1-benzylpiperidin-4-ylidene)ethanamine?
2-(1-benzylpiperidin-4-ylidene)ethanamine has a molecular weight of 216.33 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzylpiperidin-4-ylidene)ethanamine is sourced from PubChem (CID 63970705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).