1-(4-chlorophenyl)-N-piperidin-1-ylmethanimine

C12H15ClN2 — CID 2806319

IUPAC1-(4-chlorophenyl)-N-piperidin-1-ylmethanimine
SMILESClc1ccc(C=NN2CCCCC2)cc1
InChIInChI=1S/C12H15ClN2/c13-12-6-4-11(5-7-12)10-14-15-8-2-1-3-9-15/h4-7,10H,1-3,8-9H2
InChIKeyZEBXUPZBXMTIPC-UHFFFAOYSA-N
MW222.72 g/mol
LogP3.16
Rot. Bonds2

About 1-(4-chlorophenyl)-N-piperidin-1-ylmethanimine

1-(4-chlorophenyl)-N-piperidin-1-ylmethanimine (PubChem CID 2806319) has the molecular formula C12H15ClN2 and a molecular weight of 222.72 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N-piperidin-1-ylmethanimine.

Molecular Properties

Compound Name1-(4-chlorophenyl)-N-piperidin-1-ylmethanimine
PubChem CID2806319
Molecular FormulaC12H15ClN2
Molecular Weight222.72 g/mol
Exact Mass222.09
IUPAC Name1-(4-chlorophenyl)-N-piperidin-1-ylmethanimine
SMILESClc1ccc(C=NN2CCCCC2)cc1
InChIInChI=1S/C12H15ClN2/c13-12-6-4-11(5-7-12)10-14-15-8-2-1-3-9-15/h4-7,10H,1-3,8-9H2
InChIKeyZEBXUPZBXMTIPC-UHFFFAOYSA-N
XLogP3.16
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.72
LogP ≤ 53.16
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 1-(4-chlorophenyl)-N-piperidin-1-ylmethanimine?
The IUPAC name of 1-(4-chlorophenyl)-N-piperidin-1-ylmethanimine (CID 2806319) is 1-(4-chlorophenyl)-N-piperidin-1-ylmethanimine.
What is the SMILES notation for 1-(4-chlorophenyl)-N-piperidin-1-ylmethanimine?
The canonical SMILES for 1-(4-chlorophenyl)-N-piperidin-1-ylmethanimine is Clc1ccc(C=NN2CCCCC2)cc1.
What is the InChIKey of 1-(4-chlorophenyl)-N-piperidin-1-ylmethanimine?
The InChIKey is ZEBXUPZBXMTIPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN2/c13-12-6-4-11(5-7-12)10-14-15-8-2-1-3-9-15/h4-7,10H,1-3,8-9H2.
What are the key properties of 1-(4-chlorophenyl)-N-piperidin-1-ylmethanimine?
1-(4-chlorophenyl)-N-piperidin-1-ylmethanimine has a molecular weight of 222.72 g/mol, XLogP of 3.16, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-N-piperidin-1-ylmethanimine is sourced from PubChem (CID 2806319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).