4-(4-chlorophenyl)-4-(methoxymethyl)piperidine

C13H18ClNO — CID 58117649

IUPAC4-(4-chlorophenyl)-4-(methoxymethyl)piperidine
SMILESCOCC1(c2ccc(Cl)cc2)CCNCC1
InChIInChI=1S/C13H18ClNO/c1-16-10-13(6-8-15-9-7-13)11-2-4-12(14)5-3-11/h2-5,15H,6-10H2,1H3
InChIKeyGYBJYOOZYNWYDN-UHFFFAOYSA-N
MW239.75 g/mol
LogP2.61
Rot. Bonds3

About 4-(4-chlorophenyl)-4-(methoxymethyl)piperidine

4-(4-chlorophenyl)-4-(methoxymethyl)piperidine (PubChem CID 58117649) has the molecular formula C13H18ClNO and a molecular weight of 239.75 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-4-(methoxymethyl)piperidine.

Molecular Properties

Compound Name4-(4-chlorophenyl)-4-(methoxymethyl)piperidine
PubChem CID58117649
Molecular FormulaC13H18ClNO
Molecular Weight239.75 g/mol
Exact Mass239.11
IUPAC Name4-(4-chlorophenyl)-4-(methoxymethyl)piperidine
SMILESCOCC1(c2ccc(Cl)cc2)CCNCC1
InChIInChI=1S/C13H18ClNO/c1-16-10-13(6-8-15-9-7-13)11-2-4-12(14)5-3-11/h2-5,15H,6-10H2,1H3
InChIKeyGYBJYOOZYNWYDN-UHFFFAOYSA-N
XLogP2.61
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.75
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(methoxymethyl)-4-(4-propan-2-ylphenyl)piperidine
CID 82480025
[4-(4-chlorophenyl)piperidin-4-yl]methanamine;ethane
CID 143339018
4-[4-[1-(methoxymethyl)cyclopropyl]phenyl]piperidine
CID 117116547
2-(4-chlorophenyl)-2-(methoxymethyl)piperidine
CID 117272084
CID 123885865
CID 123885865
(6S)-6-(3-chloro-4-fluorophenyl)-1-(methoxymethyl)-3-azabicyclo[4.1.0]heptane
CID 143641570
4-(4-chlorophenyl)-4-(2-fluoro-2-phenoxyethyl)piperidine;hydrochloride
CID 67463846
(1S,6S)-6-(3,4-dichlorophenyl)-1-(methoxymethyl)-3-azabicyclo[4.1.0]heptane
CID 68917869
4-[1-(2,5-dichlorophenyl)ethoxymethyl]-4-phenylpiperidine
CID 57247335
N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-4-methoxypiperidine-4-carboxamide
CID 119769965
4-[1-(methoxymethyl)cyclopentyl]benzonitrile
CID 67480439
4-(methoxymethyl)-4-(2,4,6-trimethylphenyl)piperidine
CID 82480029

Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-4-(methoxymethyl)piperidine?
The IUPAC name of 4-(4-chlorophenyl)-4-(methoxymethyl)piperidine (CID 58117649) is 4-(4-chlorophenyl)-4-(methoxymethyl)piperidine.
What is the SMILES notation for 4-(4-chlorophenyl)-4-(methoxymethyl)piperidine?
The canonical SMILES for 4-(4-chlorophenyl)-4-(methoxymethyl)piperidine is COCC1(c2ccc(Cl)cc2)CCNCC1.
What is the InChIKey of 4-(4-chlorophenyl)-4-(methoxymethyl)piperidine?
The InChIKey is GYBJYOOZYNWYDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClNO/c1-16-10-13(6-8-15-9-7-13)11-2-4-12(14)5-3-11/h2-5,15H,6-10H2,1H3.
What are the key properties of 4-(4-chlorophenyl)-4-(methoxymethyl)piperidine?
4-(4-chlorophenyl)-4-(methoxymethyl)piperidine has a molecular weight of 239.75 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)-4-(methoxymethyl)piperidine is sourced from PubChem (CID 58117649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).