2-[2-[(2,5-dichlorophenyl)methoxy]ethyl]piperidine

C14H19Cl2NO — CID 65317213

IUPAC2-[2-[(2,5-dichlorophenyl)methoxy]ethyl]piperidine
SMILESClc1ccc(Cl)c(COCCC2CCCCN2)c1
InChIInChI=1S/C14H19Cl2NO/c15-12-4-5-14(16)11(9-12)10-18-8-6-13-3-1-2-7-17-13/h4-5,9,13,17H,1-3,6-8,10H2
InChIKeySCDVLFPVGSJPFV-UHFFFAOYSA-N
MW288.22 g/mol
LogP4.04
Rot. Bonds5

About 2-[2-[(2,5-dichlorophenyl)methoxy]ethyl]piperidine

2-[2-[(2,5-dichlorophenyl)methoxy]ethyl]piperidine (PubChem CID 65317213) has the molecular formula C14H19Cl2NO and a molecular weight of 288.22 g/mol. Its IUPAC name is 2-[2-[(2,5-dichlorophenyl)methoxy]ethyl]piperidine.

Molecular Properties

Compound Name2-[2-[(2,5-dichlorophenyl)methoxy]ethyl]piperidine
PubChem CID65317213
Molecular FormulaC14H19Cl2NO
Molecular Weight288.22 g/mol
Exact Mass287.08
IUPAC Name2-[2-[(2,5-dichlorophenyl)methoxy]ethyl]piperidine
SMILESClc1ccc(Cl)c(COCCC2CCCCN2)c1
InChIInChI=1S/C14H19Cl2NO/c15-12-4-5-14(16)11(9-12)10-18-8-6-13-3-1-2-7-17-13/h4-5,9,13,17H,1-3,6-8,10H2
InChIKeySCDVLFPVGSJPFV-UHFFFAOYSA-N
XLogP4.04
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.22
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[(2-chlorophenyl)methoxy]ethyl]piperidine;hydrochloride
CID 56829905
(2S)-2-[2-(2,5-dichlorophenoxy)ethyl]piperidine
CID 28749903
(2S)-2-[(2,4-dichlorophenyl)methoxymethyl]piperidine
CID 35754068
(2R)-2-[2-[(2,6-difluorophenyl)methoxy]ethyl]piperidine
CID 86321767
2-[(5-chloro-2-methoxyphenyl)methoxymethyl]piperidine
CID 55060618
2-chloro-4-[2-[(2R)-piperidin-2-yl]ethoxymethyl]pyrimidine
CID 97163934
2-[2-[(4-iodophenyl)methoxy]ethyl]piperidine;hydrochloride
CID 56830523
2-[2-[(4-propan-2-ylphenyl)methoxy]ethyl]piperidine;hydrochloride
CID 56829984
2-[2-(2-tert-butyl-4-chlorophenoxy)ethyl]piperidine
CID 53408946
3,5-dichloro-2-(2-piperidin-2-ylethoxy)pyridine
CID 57061640
2-[2-[(4-methoxyphenyl)methoxy]ethyl]piperidine
CID 56830572
2-[2-(1,3-benzodioxol-5-ylmethoxy)ethyl]piperidine
CID 82354069

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(2,5-dichlorophenyl)methoxy]ethyl]piperidine?
The IUPAC name of 2-[2-[(2,5-dichlorophenyl)methoxy]ethyl]piperidine (CID 65317213) is 2-[2-[(2,5-dichlorophenyl)methoxy]ethyl]piperidine.
What is the SMILES notation for 2-[2-[(2,5-dichlorophenyl)methoxy]ethyl]piperidine?
The canonical SMILES for 2-[2-[(2,5-dichlorophenyl)methoxy]ethyl]piperidine is Clc1ccc(Cl)c(COCCC2CCCCN2)c1.
What is the InChIKey of 2-[2-[(2,5-dichlorophenyl)methoxy]ethyl]piperidine?
The InChIKey is SCDVLFPVGSJPFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19Cl2NO/c15-12-4-5-14(16)11(9-12)10-18-8-6-13-3-1-2-7-17-13/h4-5,9,13,17H,1-3,6-8,10H2.
What are the key properties of 2-[2-[(2,5-dichlorophenyl)methoxy]ethyl]piperidine?
2-[2-[(2,5-dichlorophenyl)methoxy]ethyl]piperidine has a molecular weight of 288.22 g/mol, XLogP of 4.04, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(2,5-dichlorophenyl)methoxy]ethyl]piperidine is sourced from PubChem (CID 65317213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).