5-(5-pentoxypentoxy)pentan-1-amine

C15H33NO2 — CID 18999990

IUPAC5-(5-pentoxypentoxy)pentan-1-amine
SMILESCCCCCOCCCCCOCCCCCN
InChIInChI=1S/C15H33NO2/c1-2-3-7-12-17-14-9-5-10-15-18-13-8-4-6-11-16/h2-16H2,1H3
InChIKeyLJLOGKHNCPROCG-UHFFFAOYSA-N
MW259.43 g/mol
LogP3.51
Rot. Bonds15

About 5-(5-pentoxypentoxy)pentan-1-amine

5-(5-pentoxypentoxy)pentan-1-amine (PubChem CID 18999990) has the molecular formula C15H33NO2 and a molecular weight of 259.43 g/mol. Its IUPAC name is 5-(5-pentoxypentoxy)pentan-1-amine.

Molecular Properties

Compound Name5-(5-pentoxypentoxy)pentan-1-amine
PubChem CID18999990
Molecular FormulaC15H33NO2
Molecular Weight259.43 g/mol
Exact Mass259.25
IUPAC Name5-(5-pentoxypentoxy)pentan-1-amine
SMILESCCCCCOCCCCCOCCCCCN
InChIInChI=1S/C15H33NO2/c1-2-3-7-12-17-14-9-5-10-15-18-13-8-4-6-11-16/h2-16H2,1H3
InChIKeyLJLOGKHNCPROCG-UHFFFAOYSA-N
XLogP3.51
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.43
LogP ≤ 53.51
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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Frequently Asked Questions

What is the IUPAC name of 5-(5-pentoxypentoxy)pentan-1-amine?
The IUPAC name of 5-(5-pentoxypentoxy)pentan-1-amine (CID 18999990) is 5-(5-pentoxypentoxy)pentan-1-amine.
What is the SMILES notation for 5-(5-pentoxypentoxy)pentan-1-amine?
The canonical SMILES for 5-(5-pentoxypentoxy)pentan-1-amine is CCCCCOCCCCCOCCCCCN.
What is the InChIKey of 5-(5-pentoxypentoxy)pentan-1-amine?
The InChIKey is LJLOGKHNCPROCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33NO2/c1-2-3-7-12-17-14-9-5-10-15-18-13-8-4-6-11-16/h2-16H2,1H3.
What are the key properties of 5-(5-pentoxypentoxy)pentan-1-amine?
5-(5-pentoxypentoxy)pentan-1-amine has a molecular weight of 259.43 g/mol, XLogP of 3.51, 15 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-pentoxypentoxy)pentan-1-amine is sourced from PubChem (CID 18999990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).