2-(2,5-dichloro-4-methoxyphenyl)piperidine

C12H15Cl2NO — CID 82301366

IUPAC2-(2,5-dichloro-4-methoxyphenyl)piperidine
SMILESCOc1cc(Cl)c(C2CCCCN2)cc1Cl
InChIInChI=1S/C12H15Cl2NO/c1-16-12-7-9(13)8(6-10(12)14)11-4-2-3-5-15-11/h6-7,11,15H,2-5H2,1H3
InChIKeyXJKCSWURMYTXEH-UHFFFAOYSA-N
MW260.16 g/mol
LogP3.82
Rot. Bonds2

About 2-(2,5-dichloro-4-methoxyphenyl)piperidine

2-(2,5-dichloro-4-methoxyphenyl)piperidine (PubChem CID 82301366) has the molecular formula C12H15Cl2NO and a molecular weight of 260.16 g/mol. Its IUPAC name is 2-(2,5-dichloro-4-methoxyphenyl)piperidine.

Molecular Properties

Compound Name2-(2,5-dichloro-4-methoxyphenyl)piperidine
PubChem CID82301366
Molecular FormulaC12H15Cl2NO
Molecular Weight260.16 g/mol
Exact Mass259.05
IUPAC Name2-(2,5-dichloro-4-methoxyphenyl)piperidine
SMILESCOc1cc(Cl)c(C2CCCCN2)cc1Cl
InChIInChI=1S/C12H15Cl2NO/c1-16-12-7-9(13)8(6-10(12)14)11-4-2-3-5-15-11/h6-7,11,15H,2-5H2,1H3
InChIKeyXJKCSWURMYTXEH-UHFFFAOYSA-N
XLogP3.82
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.16
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-chloro-2-fluoro-4-methoxyphenyl)piperidine
CID 84704156
5-chloro-2-methoxy-4-[(2S)-pyrrolidin-2-yl]aniline
CID 66519127
2-(2,5-dichloro-3-methoxyphenyl)piperidine
CID 117404132
2-(2,3-dichloro-4-methoxyphenyl)piperidine
CID 116962306
2-(5-chloro-2-methoxyphenyl)azepane
CID 4015818
2-(2,4,5-trimethoxyphenyl)azepane
CID 62543409
2-(5-chloro-2,3-difluoro-4-methoxyphenyl)piperidine
CID 117409054
2-(3,5-dichloro-2-methoxyphenyl)piperidine
CID 82301361
2-(5-bromo-2-fluoro-4-methoxyphenyl)piperidine
CID 84814359
2-(2,5-dimethoxy-4-propan-2-ylphenyl)piperidine
CID 117413709
2-(2,3,4-trimethoxyphenyl)azepane
CID 62543922
(2S)-2-(2,4-dimethoxyphenyl)piperidine
CID 7022848

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichloro-4-methoxyphenyl)piperidine?
The IUPAC name of 2-(2,5-dichloro-4-methoxyphenyl)piperidine (CID 82301366) is 2-(2,5-dichloro-4-methoxyphenyl)piperidine.
What is the SMILES notation for 2-(2,5-dichloro-4-methoxyphenyl)piperidine?
The canonical SMILES for 2-(2,5-dichloro-4-methoxyphenyl)piperidine is COc1cc(Cl)c(C2CCCCN2)cc1Cl.
What is the InChIKey of 2-(2,5-dichloro-4-methoxyphenyl)piperidine?
The InChIKey is XJKCSWURMYTXEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15Cl2NO/c1-16-12-7-9(13)8(6-10(12)14)11-4-2-3-5-15-11/h6-7,11,15H,2-5H2,1H3.
What are the key properties of 2-(2,5-dichloro-4-methoxyphenyl)piperidine?
2-(2,5-dichloro-4-methoxyphenyl)piperidine has a molecular weight of 260.16 g/mol, XLogP of 3.82, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichloro-4-methoxyphenyl)piperidine is sourced from PubChem (CID 82301366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).