N-phenyl-3-prop-2-enylpiperidin-4-amine

C14H20N2 — CID 13065730

IUPACN-phenyl-3-prop-2-enylpiperidin-4-amine
SMILESC=CCC1CNCCC1Nc1ccccc1
InChIInChI=1S/C14H20N2/c1-2-6-12-11-15-10-9-14(12)16-13-7-4-3-5-8-13/h2-5,7-8,12,14-16H,1,6,9-11H2
InChIKeySDHJHFDVEWLPOF-UHFFFAOYSA-N
MW216.33 g/mol
LogP2.65
Rot. Bonds4

About N-phenyl-3-prop-2-enylpiperidin-4-amine

N-phenyl-3-prop-2-enylpiperidin-4-amine (PubChem CID 13065730) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is N-phenyl-3-prop-2-enylpiperidin-4-amine.

Molecular Properties

Compound NameN-phenyl-3-prop-2-enylpiperidin-4-amine
PubChem CID13065730
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC NameN-phenyl-3-prop-2-enylpiperidin-4-amine
SMILESC=CCC1CNCCC1Nc1ccccc1
InChIInChI=1S/C14H20N2/c1-2-6-12-11-15-10-9-14(12)16-13-7-4-3-5-8-13/h2-5,7-8,12,14-16H,1,6,9-11H2
InChIKeySDHJHFDVEWLPOF-UHFFFAOYSA-N
XLogP2.65
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-phenyl-3-prop-2-enylpiperidin-4-amine?
The IUPAC name of N-phenyl-3-prop-2-enylpiperidin-4-amine (CID 13065730) is N-phenyl-3-prop-2-enylpiperidin-4-amine.
What is the SMILES notation for N-phenyl-3-prop-2-enylpiperidin-4-amine?
The canonical SMILES for N-phenyl-3-prop-2-enylpiperidin-4-amine is C=CCC1CNCCC1Nc1ccccc1.
What is the InChIKey of N-phenyl-3-prop-2-enylpiperidin-4-amine?
The InChIKey is SDHJHFDVEWLPOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-2-6-12-11-15-10-9-14(12)16-13-7-4-3-5-8-13/h2-5,7-8,12,14-16H,1,6,9-11H2.
What are the key properties of N-phenyl-3-prop-2-enylpiperidin-4-amine?
N-phenyl-3-prop-2-enylpiperidin-4-amine has a molecular weight of 216.33 g/mol, XLogP of 2.65, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-3-prop-2-enylpiperidin-4-amine is sourced from PubChem (CID 13065730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).