2-(3,5-dichloro-2-methoxyphenyl)piperidine

C12H15Cl2NO — CID 82301361

IUPAC2-(3,5-dichloro-2-methoxyphenyl)piperidine
SMILESCOc1c(Cl)cc(Cl)cc1C1CCCCN1
InChIInChI=1S/C12H15Cl2NO/c1-16-12-9(6-8(13)7-10(12)14)11-4-2-3-5-15-11/h6-7,11,15H,2-5H2,1H3
InChIKeyIQVUTUNYEWYPAI-UHFFFAOYSA-N
MW260.16 g/mol
LogP3.82
Rot. Bonds2

About 2-(3,5-dichloro-2-methoxyphenyl)piperidine

2-(3,5-dichloro-2-methoxyphenyl)piperidine (PubChem CID 82301361) has the molecular formula C12H15Cl2NO and a molecular weight of 260.16 g/mol. Its IUPAC name is 2-(3,5-dichloro-2-methoxyphenyl)piperidine.

Molecular Properties

Compound Name2-(3,5-dichloro-2-methoxyphenyl)piperidine
PubChem CID82301361
Molecular FormulaC12H15Cl2NO
Molecular Weight260.16 g/mol
Exact Mass259.05
IUPAC Name2-(3,5-dichloro-2-methoxyphenyl)piperidine
SMILESCOc1c(Cl)cc(Cl)cc1C1CCCCN1
InChIInChI=1S/C12H15Cl2NO/c1-16-12-9(6-8(13)7-10(12)14)11-4-2-3-5-15-11/h6-7,11,15H,2-5H2,1H3
InChIKeyIQVUTUNYEWYPAI-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-2,3-difluoro-4-methoxyphenyl)piperidine
CID 117409054
2-(5-chloro-2-cyclopentyloxy-3-methoxyphenyl)piperidine
CID 117494554
2-(2,5-dichloro-3-methoxyphenyl)piperidine
CID 117404132
2-(5-chloro-2-methoxy-3-propan-2-ylphenyl)pyrrolidine
CID 117387937
2-(5-chloro-2-methoxyphenyl)azepane
CID 4015818
2-(2,5-dichloro-4-methoxyphenyl)piperidine
CID 82301366
(2R)-2-(3-chloro-4,5-dimethoxyphenyl)azepane
CID 7144642
2-(5-chloro-2-fluoro-4-methoxyphenyl)piperidine
CID 84704156
2-(3-chloro-5-fluoro-2-methoxy-6-methylphenyl)piperidine
CID 117397972
2,4-dichloro-6-[(2S)-pyrrolidin-2-yl]aniline
CID 66519219
(2R)-2-(2,4-dichlorophenyl)piperidine;hydrochloride
CID 171195657
(2S)-2-(3-chloro-5-methoxyphenyl)piperidine
CID 131500091

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dichloro-2-methoxyphenyl)piperidine?
The IUPAC name of 2-(3,5-dichloro-2-methoxyphenyl)piperidine (CID 82301361) is 2-(3,5-dichloro-2-methoxyphenyl)piperidine.
What is the SMILES notation for 2-(3,5-dichloro-2-methoxyphenyl)piperidine?
The canonical SMILES for 2-(3,5-dichloro-2-methoxyphenyl)piperidine is COc1c(Cl)cc(Cl)cc1C1CCCCN1.
What is the InChIKey of 2-(3,5-dichloro-2-methoxyphenyl)piperidine?
The InChIKey is IQVUTUNYEWYPAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15Cl2NO/c1-16-12-9(6-8(13)7-10(12)14)11-4-2-3-5-15-11/h6-7,11,15H,2-5H2,1H3.
What are the key properties of 2-(3,5-dichloro-2-methoxyphenyl)piperidine?
2-(3,5-dichloro-2-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-(3,5-dichloro-2-methoxyphenyl)piperidine is sourced from PubChem (CID 82301361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).