(Z)-1-(4-ethylphenyl)-N-piperidin-1-ylmethanimine

C14H20N2 — CID 45095239

IUPAC(Z)-1-(4-ethylphenyl)-N-piperidin-1-ylmethanimine
SMILESCCc1ccc(/C=N\N2CCCCC2)cc1
InChIInChI=1S/C14H20N2/c1-2-13-6-8-14(9-7-13)12-15-16-10-4-3-5-11-16/h6-9,12H,2-5,10-11H2,1H3/b15-12-
InChIKeyJJYSVOKCHGQOSD-QINSGFPZSA-N
MW216.33 g/mol
LogP3.07
Rot. Bonds3

About (Z)-1-(4-ethylphenyl)-N-piperidin-1-ylmethanimine

(Z)-1-(4-ethylphenyl)-N-piperidin-1-ylmethanimine (PubChem CID 45095239) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is (Z)-1-(4-ethylphenyl)-N-piperidin-1-ylmethanimine.

Molecular Properties

Compound Name(Z)-1-(4-ethylphenyl)-N-piperidin-1-ylmethanimine
PubChem CID45095239
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name(Z)-1-(4-ethylphenyl)-N-piperidin-1-ylmethanimine
SMILESCCc1ccc(/C=N\N2CCCCC2)cc1
InChIInChI=1S/C14H20N2/c1-2-13-6-8-14(9-7-13)12-15-16-10-4-3-5-11-16/h6-9,12H,2-5,10-11H2,1H3/b15-12-
InChIKeyJJYSVOKCHGQOSD-QINSGFPZSA-N
XLogP3.07
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-(4-ethylphenyl)-N-piperidin-1-ylmethanimine?
The IUPAC name of (Z)-1-(4-ethylphenyl)-N-piperidin-1-ylmethanimine (CID 45095239) is (Z)-1-(4-ethylphenyl)-N-piperidin-1-ylmethanimine.
What is the SMILES notation for (Z)-1-(4-ethylphenyl)-N-piperidin-1-ylmethanimine?
The canonical SMILES for (Z)-1-(4-ethylphenyl)-N-piperidin-1-ylmethanimine is CCc1ccc(/C=N\N2CCCCC2)cc1.
What is the InChIKey of (Z)-1-(4-ethylphenyl)-N-piperidin-1-ylmethanimine?
The InChIKey is JJYSVOKCHGQOSD-QINSGFPZSA-N. The full InChI is InChI=1S/C14H20N2/c1-2-13-6-8-14(9-7-13)12-15-16-10-4-3-5-11-16/h6-9,12H,2-5,10-11H2,1H3/b15-12-.
What are the key properties of (Z)-1-(4-ethylphenyl)-N-piperidin-1-ylmethanimine?
(Z)-1-(4-ethylphenyl)-N-piperidin-1-ylmethanimine has a molecular weight of 216.33 g/mol, XLogP of 3.07, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-(4-ethylphenyl)-N-piperidin-1-ylmethanimine is sourced from PubChem (CID 45095239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).