4-(2-methoxyethyl)-1-octylpiperidine

C16H33NO — CID 134254922

IUPAC4-(2-methoxyethyl)-1-octylpiperidine
SMILESCCCCCCCCN1CCC(CCOC)CC1
InChIInChI=1S/C16H33NO/c1-3-4-5-6-7-8-12-17-13-9-16(10-14-17)11-15-18-2/h16H,3-15H2,1-2H3
InChIKeyPXPGMNBLUNBFOE-UHFFFAOYSA-N
MW255.45 g/mol
LogP4.10
Rot. Bonds10

About 4-(2-methoxyethyl)-1-octylpiperidine

4-(2-methoxyethyl)-1-octylpiperidine (PubChem CID 134254922) has the molecular formula C16H33NO and a molecular weight of 255.45 g/mol. Its IUPAC name is 4-(2-methoxyethyl)-1-octylpiperidine.

Molecular Properties

Compound Name4-(2-methoxyethyl)-1-octylpiperidine
PubChem CID134254922
Molecular FormulaC16H33NO
Molecular Weight255.45 g/mol
Exact Mass255.26
IUPAC Name4-(2-methoxyethyl)-1-octylpiperidine
SMILESCCCCCCCCN1CCC(CCOC)CC1
InChIInChI=1S/C16H33NO/c1-3-4-5-6-7-8-12-17-13-9-16(10-14-17)11-15-18-2/h16H,3-15H2,1-2H3
InChIKeyPXPGMNBLUNBFOE-UHFFFAOYSA-N
XLogP4.10
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 54.10
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

4-butyl-1-octylpiperidine
CID 171570418
4-butyl-1-heptylpiperidine;formonitrile
CID 175849547
1-methyl-4-[2-(1-pentadecylpiperidin-4-yl)ethyl]piperidine;hydrochloride
CID 45263278
4-(4-octylpiperidin-1-yl)butan-1-ol
CID 71395098
4-(4-nonylpiperidin-1-yl)butan-1-ol
CID 71395100
4-(4-octylpiperidin-1-yl)butan-1-ol;hydrochloride
CID 71395097
5-(4-hexylpiperidin-1-yl)pentan-1-ol;hydrochloride
CID 23328916
4-(5-methoxypentan-2-yl)-1-pentadecylpiperidine
CID 58623460
4-butyl-1-hexylpiperidine;methanesulfonic acid
CID 175583852
4-butyl-1-undecylpiperidine;methanesulfonic acid
CID 175583862
methanesulfonic acid;4-propyl-1-undecylpiperidine
CID 175583605
4-[2-(3,5-dichlorophenoxy)ethyl]-1-pentylpiperidine
CID 54424720

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyethyl)-1-octylpiperidine?
The IUPAC name of 4-(2-methoxyethyl)-1-octylpiperidine (CID 134254922) is 4-(2-methoxyethyl)-1-octylpiperidine.
What is the SMILES notation for 4-(2-methoxyethyl)-1-octylpiperidine?
The canonical SMILES for 4-(2-methoxyethyl)-1-octylpiperidine is CCCCCCCCN1CCC(CCOC)CC1.
What is the InChIKey of 4-(2-methoxyethyl)-1-octylpiperidine?
The InChIKey is PXPGMNBLUNBFOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO/c1-3-4-5-6-7-8-12-17-13-9-16(10-14-17)11-15-18-2/h16H,3-15H2,1-2H3.
What are the key properties of 4-(2-methoxyethyl)-1-octylpiperidine?
4-(2-methoxyethyl)-1-octylpiperidine has a molecular weight of 255.45 g/mol, XLogP of 4.10, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyethyl)-1-octylpiperidine is sourced from PubChem (CID 134254922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).