1-[6-(4-methoxyphenyl)hexyl]piperidine

C18H29NO — CID 129295861

IUPAC1-[6-(4-methoxyphenyl)hexyl]piperidine
SMILESCOc1ccc(CCCCCCN2CCCCC2)cc1
InChIInChI=1S/C18H29NO/c1-20-18-12-10-17(11-13-18)9-5-2-3-6-14-19-15-7-4-8-16-19/h10-13H,2-9,14-16H2,1H3
InChIKeyWIUNEKQSGLOENI-UHFFFAOYSA-N
MW275.44 g/mol
LogP4.28
Rot. Bonds8

About 1-[6-(4-methoxyphenyl)hexyl]piperidine

1-[6-(4-methoxyphenyl)hexyl]piperidine (PubChem CID 129295861) has the molecular formula C18H29NO and a molecular weight of 275.44 g/mol. Its IUPAC name is 1-[6-(4-methoxyphenyl)hexyl]piperidine.

Molecular Properties

Compound Name1-[6-(4-methoxyphenyl)hexyl]piperidine
PubChem CID129295861
Molecular FormulaC18H29NO
Molecular Weight275.44 g/mol
Exact Mass275.22
IUPAC Name1-[6-(4-methoxyphenyl)hexyl]piperidine
SMILESCOc1ccc(CCCCCCN2CCCCC2)cc1
InChIInChI=1S/C18H29NO/c1-20-18-12-10-17(11-13-18)9-5-2-3-6-14-19-15-7-4-8-16-19/h10-13H,2-9,14-16H2,1H3
InChIKeyWIUNEKQSGLOENI-UHFFFAOYSA-N
XLogP4.28
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[3-(4-methoxyphenyl)propyl]piperidine
CID 42640027
2-(4-methoxyphenyl)-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]acetamide
CID 110314406
1-[4-[4-[2-(4-methoxyphenyl)naphthalen-1-yl]oxyphenyl]butyl]piperidine
CID 70015592
3-[4-[2-(4-methoxyphenyl)ethyl]-1,4-diazepan-1-yl]propan-1-amine
CID 65431024
1-(11-phenylundecyl)piperidine;hydrochloride
CID 173446957
5-[4-[3-(azepan-1-yl)propoxy]phenyl]pentan-1-ol
CID 52937427
13-(4-methoxyphenyl)-1-pyrrolidin-1-yltridecan-1-one
CID 11793763
2-(4-methoxyphenyl)-N-(3-piperidin-1-ylpropyl)acetamide
CID 92674422
1-[2-(4-octylphenyl)ethyl]azepane
CID 71546091
6-[4-(3-piperidin-1-ylpropoxy)phenyl]hexanoic acid
CID 142626546
4-(4-methoxyphenyl)-4-oxo-N-[4-(3-pyrrolidin-1-ylpropyl)phenyl]butanamide
CID 110633790
1-[3-(4-propylphenoxy)propyl]azepane
CID 91586553

Frequently Asked Questions

What is the IUPAC name of 1-[6-(4-methoxyphenyl)hexyl]piperidine?
The IUPAC name of 1-[6-(4-methoxyphenyl)hexyl]piperidine (CID 129295861) is 1-[6-(4-methoxyphenyl)hexyl]piperidine.
What is the SMILES notation for 1-[6-(4-methoxyphenyl)hexyl]piperidine?
The canonical SMILES for 1-[6-(4-methoxyphenyl)hexyl]piperidine is COc1ccc(CCCCCCN2CCCCC2)cc1.
What is the InChIKey of 1-[6-(4-methoxyphenyl)hexyl]piperidine?
The InChIKey is WIUNEKQSGLOENI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO/c1-20-18-12-10-17(11-13-18)9-5-2-3-6-14-19-15-7-4-8-16-19/h10-13H,2-9,14-16H2,1H3.
What are the key properties of 1-[6-(4-methoxyphenyl)hexyl]piperidine?
1-[6-(4-methoxyphenyl)hexyl]piperidine has a molecular weight of 275.44 g/mol, XLogP of 4.28, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(4-methoxyphenyl)hexyl]piperidine is sourced from PubChem (CID 129295861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).