1-(3,3-diphenylpropyl)-4-ethenylpiperidine

C22H27N — CID 89209836

IUPAC1-(3,3-diphenylpropyl)-4-ethenylpiperidine
SMILESC=CC1CCN(CCC(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C22H27N/c1-2-19-13-16-23(17-14-19)18-15-22(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h2-12,19,22H,1,13-18H2
InChIKeyWPYRMPHRSIZLKY-UHFFFAOYSA-N
MW305.47 g/mol
LogP5.11
Rot. Bonds6

About 1-(3,3-diphenylpropyl)-4-ethenylpiperidine

1-(3,3-diphenylpropyl)-4-ethenylpiperidine (PubChem CID 89209836) has the molecular formula C22H27N and a molecular weight of 305.47 g/mol. Its IUPAC name is 1-(3,3-diphenylpropyl)-4-ethenylpiperidine.

Molecular Properties

Compound Name1-(3,3-diphenylpropyl)-4-ethenylpiperidine
PubChem CID89209836
Molecular FormulaC22H27N
Molecular Weight305.47 g/mol
Exact Mass305.21
IUPAC Name1-(3,3-diphenylpropyl)-4-ethenylpiperidine
SMILESC=CC1CCN(CCC(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C22H27N/c1-2-19-13-16-23(17-14-19)18-15-22(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h2-12,19,22H,1,13-18H2
InChIKeyWPYRMPHRSIZLKY-UHFFFAOYSA-N
XLogP5.11
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500305.47
LogP ≤ 55.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(3S)-1-(3,3-diphenylpropyl)pyrrolidin-3-amine
CID 58636592
1-(3,3-diphenylpropyl)azepane;hydrochloride
CID 3084164
benzyl 1-(3,3-diphenylpropyl)piperidine-4-carboxylate
CID 25223025
1-(3,3-diphenylpropyl)piperidin-4-amine;bis(2,2,2-trifluoroacetic acid)
CID 22254650
N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-N-methylbenzamide
CID 18381967
(3aR,7aS)-3-[1-(3,3-diphenylpropyl)piperidin-4-yl]-3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-one
CID 10112700
1-acetyl-3-[1-(3,3-diphenylpropyl)piperidin-4-yl]benzimidazol-2-one
CID 10297842
N-[1-(3-phenylbutyl)piperidin-4-yl]-N-prop-2-enylpyrimidin-2-amine
CID 89147972
N-(3,3-diphenylpropyl)-1-propylpiperidin-4-amine
CID 2846321
1-(2,2-diphenylethyl)-3-methylpyrrolidine
CID 22949855
N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(4-hydroxyphenyl)acetamide
CID 25205927
1-(3,3-diphenylpropyl)-N-(2-phenylethyl)piperidine-4-carboxamide
CID 25223132

Frequently Asked Questions

What is the IUPAC name of 1-(3,3-diphenylpropyl)-4-ethenylpiperidine?
The IUPAC name of 1-(3,3-diphenylpropyl)-4-ethenylpiperidine (CID 89209836) is 1-(3,3-diphenylpropyl)-4-ethenylpiperidine.
What is the SMILES notation for 1-(3,3-diphenylpropyl)-4-ethenylpiperidine?
The canonical SMILES for 1-(3,3-diphenylpropyl)-4-ethenylpiperidine is C=CC1CCN(CCC(c2ccccc2)c2ccccc2)CC1.
What is the InChIKey of 1-(3,3-diphenylpropyl)-4-ethenylpiperidine?
The InChIKey is WPYRMPHRSIZLKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N/c1-2-19-13-16-23(17-14-19)18-15-22(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h2-12,19,22H,1,13-18H2.
What are the key properties of 1-(3,3-diphenylpropyl)-4-ethenylpiperidine?
1-(3,3-diphenylpropyl)-4-ethenylpiperidine has a molecular weight of 305.47 g/mol, XLogP of 5.11, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,3-diphenylpropyl)-4-ethenylpiperidine is sourced from PubChem (CID 89209836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).