5-[5-(1-ethylpiperidin-4-yl)pentoxy]pentan-1-ol

C17H35NO2 — CID 142365203

IUPAC5-[5-(1-ethylpiperidin-4-yl)pentoxy]pentan-1-ol
SMILESCCN1CCC(CCCCCOCCCCCO)CC1
InChIInChI=1S/C17H35NO2/c1-2-18-12-10-17(11-13-18)9-5-3-7-15-20-16-8-4-6-14-19/h17,19H,2-16H2,1H3
InChIKeyMZBJDMZUTHIRAR-UHFFFAOYSA-N
MW285.47 g/mol
LogP3.46
Rot. Bonds12

About 5-[5-(1-ethylpiperidin-4-yl)pentoxy]pentan-1-ol

5-[5-(1-ethylpiperidin-4-yl)pentoxy]pentan-1-ol (PubChem CID 142365203) has the molecular formula C17H35NO2 and a molecular weight of 285.47 g/mol. Its IUPAC name is 5-[5-(1-ethylpiperidin-4-yl)pentoxy]pentan-1-ol.

Molecular Properties

Compound Name5-[5-(1-ethylpiperidin-4-yl)pentoxy]pentan-1-ol
PubChem CID142365203
Molecular FormulaC17H35NO2
Molecular Weight285.47 g/mol
Exact Mass285.27
IUPAC Name5-[5-(1-ethylpiperidin-4-yl)pentoxy]pentan-1-ol
SMILESCCN1CCC(CCCCCOCCCCCO)CC1
InChIInChI=1S/C17H35NO2/c1-2-18-12-10-17(11-13-18)9-5-3-7-15-20-16-8-4-6-14-19/h17,19H,2-16H2,1H3
InChIKeyMZBJDMZUTHIRAR-UHFFFAOYSA-N
XLogP3.46
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.47
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-(4-nonylpiperidin-1-yl)butan-1-ol
CID 71395100
4-(4-octylpiperidin-1-yl)butan-1-ol
CID 71395098
4-(4-octylpiperidin-1-yl)butan-1-ol;hydrochloride
CID 71395097
5-(4-hexylpiperidin-1-yl)pentan-1-ol;hydrochloride
CID 23328916
4-butyl-1-ethylpiperidine;hydrofluoride
CID 175875172
5-(1-ethylpiperidin-4-yl)pentanoic acid
CID 165463146
2-(4-nonylpiperidin-1-yl)ethanol;hydrochloride
CID 71395103
4-[4-(6-methylheptyl)piperidin-1-yl]butan-1-ol
CID 71395080
ethyl 4-(4-hydroxybutyl)piperidine-1-carboxylate
CID 19748294
N-[(1-ethylpiperidin-4-yl)methyl]-4-hydroxybutane-1-sulfonamide
CID 114134633
3-[4-[2-(2-chloroethoxy)ethyl]piperidin-1-yl]propan-1-ol
CID 67282001
9-nonoxynonan-1-ol
CID 57318642

Frequently Asked Questions

What is the IUPAC name of 5-[5-(1-ethylpiperidin-4-yl)pentoxy]pentan-1-ol?
The IUPAC name of 5-[5-(1-ethylpiperidin-4-yl)pentoxy]pentan-1-ol (CID 142365203) is 5-[5-(1-ethylpiperidin-4-yl)pentoxy]pentan-1-ol.
What is the SMILES notation for 5-[5-(1-ethylpiperidin-4-yl)pentoxy]pentan-1-ol?
The canonical SMILES for 5-[5-(1-ethylpiperidin-4-yl)pentoxy]pentan-1-ol is CCN1CCC(CCCCCOCCCCCO)CC1.
What is the InChIKey of 5-[5-(1-ethylpiperidin-4-yl)pentoxy]pentan-1-ol?
The InChIKey is MZBJDMZUTHIRAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35NO2/c1-2-18-12-10-17(11-13-18)9-5-3-7-15-20-16-8-4-6-14-19/h17,19H,2-16H2,1H3.
What are the key properties of 5-[5-(1-ethylpiperidin-4-yl)pentoxy]pentan-1-ol?
5-[5-(1-ethylpiperidin-4-yl)pentoxy]pentan-1-ol has a molecular weight of 285.47 g/mol, XLogP of 3.46, 12 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-(1-ethylpiperidin-4-yl)pentoxy]pentan-1-ol is sourced from PubChem (CID 142365203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).