4-(2,4-dichloro-6-methoxyphenyl)piperidine

C12H15Cl2NO — CID 156722732

IUPAC4-(2,4-dichloro-6-methoxyphenyl)piperidine
SMILESCOc1cc(Cl)cc(Cl)c1C1CCNCC1
InChIInChI=1S/C12H15Cl2NO/c1-16-11-7-9(13)6-10(14)12(11)8-2-4-15-5-3-8/h6-8,15H,2-5H2,1H3
InChIKeyKBJDPQGAPHWCNR-UHFFFAOYSA-N
MW260.16 g/mol
LogP3.47
Rot. Bonds2

About 4-(2,4-dichloro-6-methoxyphenyl)piperidine

4-(2,4-dichloro-6-methoxyphenyl)piperidine (PubChem CID 156722732) has the molecular formula C12H15Cl2NO and a molecular weight of 260.16 g/mol. Its IUPAC name is 4-(2,4-dichloro-6-methoxyphenyl)piperidine.

Molecular Properties

Compound Name4-(2,4-dichloro-6-methoxyphenyl)piperidine
PubChem CID156722732
Molecular FormulaC12H15Cl2NO
Molecular Weight260.16 g/mol
Exact Mass259.05
IUPAC Name4-(2,4-dichloro-6-methoxyphenyl)piperidine
SMILESCOc1cc(Cl)cc(Cl)c1C1CCNCC1
InChIInChI=1S/C12H15Cl2NO/c1-16-11-7-9(13)6-10(14)12(11)8-2-4-15-5-3-8/h6-8,15H,2-5H2,1H3
InChIKeyKBJDPQGAPHWCNR-UHFFFAOYSA-N
XLogP3.47
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 ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-chloro-4-cyclopropyl-5-methoxyphenyl)pyrrolidine
CID 117382800
4-(2-chloro-6-fluoro-3-methoxyphenyl)piperidine
CID 84802229
4-(4-chloro-2-methoxy-5-methylphenyl)piperidine
CID 83392391
3-chloro-4-cyclopropyl-5-methoxyphenol
CID 84668563
3-fluoro-5-methoxy-4-piperidin-4-ylphenol
CID 84790128
4-[(5-chloro-3-methoxy-2-methylphenyl)methyl]piperidine
CID 117387723
3-(4-fluoro-2,6-dimethoxyphenyl)pyrrolidine
CID 117323606
4-(3-chloro-2,4,5-trimethoxyphenyl)piperidine
CID 117460328
3-(2-chloro-3,6-dimethoxy-4-methylphenyl)pyrrolidine
CID 117392479
4-(6-bromo-3,4-dimethoxy-2-methylphenyl)piperidine
CID 117499633
4-(3-bromo-4-methoxy-2,6-dimethylphenyl)piperidine
CID 117480591
3-(6-chloro-3-methoxy-2,4-dimethylphenyl)pyrrolidine
CID 117352217

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dichloro-6-methoxyphenyl)piperidine?
The IUPAC name of 4-(2,4-dichloro-6-methoxyphenyl)piperidine (CID 156722732) is 4-(2,4-dichloro-6-methoxyphenyl)piperidine.
What is the SMILES notation for 4-(2,4-dichloro-6-methoxyphenyl)piperidine?
The canonical SMILES for 4-(2,4-dichloro-6-methoxyphenyl)piperidine is COc1cc(Cl)cc(Cl)c1C1CCNCC1.
What is the InChIKey of 4-(2,4-dichloro-6-methoxyphenyl)piperidine?
The InChIKey is KBJDPQGAPHWCNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15Cl2NO/c1-16-11-7-9(13)6-10(14)12(11)8-2-4-15-5-3-8/h6-8,15H,2-5H2,1H3.
What are the key properties of 4-(2,4-dichloro-6-methoxyphenyl)piperidine?
4-(2,4-dichloro-6-methoxyphenyl)piperidine has a molecular weight of 260.16 g/mol, XLogP of 3.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dichloro-6-methoxyphenyl)piperidine is sourced from PubChem (CID 156722732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).