4-(4-chlorophenyl)piperidine;ethane

C13H20ClN — CID 143751340

IUPAC4-(4-chlorophenyl)piperidine;ethane
SMILESCC.Clc1ccc(C2CCNCC2)cc1
InChIInChI=1S/C11H14ClN.C2H6/c12-11-3-1-9(2-4-11)10-5-7-13-8-6-10;1-2/h1-4,10,13H,5-8H2;1-2H3
InChIKeyAMBLYLUNGAIKSX-UHFFFAOYSA-N
MW225.76 g/mol
LogP3.83
Rot. Bonds1

About 4-(4-chlorophenyl)piperidine;ethane

4-(4-chlorophenyl)piperidine;ethane (PubChem CID 143751340) has the molecular formula C13H20ClN and a molecular weight of 225.76 g/mol. Its IUPAC name is 4-(4-chlorophenyl)piperidine;ethane.

Molecular Properties

Compound Name4-(4-chlorophenyl)piperidine;ethane
PubChem CID143751340
Molecular FormulaC13H20ClN
Molecular Weight225.76 g/mol
Exact Mass225.13
IUPAC Name4-(4-chlorophenyl)piperidine;ethane
SMILESCC.Clc1ccc(C2CCNCC2)cc1
InChIInChI=1S/C11H14ClN.C2H6/c12-11-3-1-9(2-4-11)10-5-7-13-8-6-10;1-2/h1-4,10,13H,5-8H2;1-2H3
InChIKeyAMBLYLUNGAIKSX-UHFFFAOYSA-N
XLogP3.83
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.76
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)piperidine;ethane?
The IUPAC name of 4-(4-chlorophenyl)piperidine;ethane (CID 143751340) is 4-(4-chlorophenyl)piperidine;ethane.
What is the SMILES notation for 4-(4-chlorophenyl)piperidine;ethane?
The canonical SMILES for 4-(4-chlorophenyl)piperidine;ethane is CC.Clc1ccc(C2CCNCC2)cc1.
What is the InChIKey of 4-(4-chlorophenyl)piperidine;ethane?
The InChIKey is AMBLYLUNGAIKSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN.C2H6/c12-11-3-1-9(2-4-11)10-5-7-13-8-6-10;1-2/h1-4,10,13H,5-8H2;1-2H3.
What are the key properties of 4-(4-chlorophenyl)piperidine;ethane?
4-(4-chlorophenyl)piperidine;ethane has a molecular weight of 225.76 g/mol, XLogP of 3.83, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)piperidine;ethane is sourced from PubChem (CID 143751340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).