8-aminooctan-1-ol;1,3-oxazolidine

C11H26N2O2 — CID 70474825

IUPAC8-aminooctan-1-ol;1,3-oxazolidine
SMILESC1COCN1.NCCCCCCCCO
InChIInChI=1S/C8H19NO.C3H7NO/c9-7-5-3-1-2-4-6-8-10;1-2-5-3-4-1/h10H,1-9H2;4H,1-3H2
InChIKeyUUBTVANHAVVQQT-UHFFFAOYSA-N
MW218.34 g/mol
LogP0.84
Rot. Bonds7

About 8-aminooctan-1-ol;1,3-oxazolidine

8-aminooctan-1-ol;1,3-oxazolidine (PubChem CID 70474825) has the molecular formula C11H26N2O2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 8-aminooctan-1-ol;1,3-oxazolidine.

Molecular Properties

Compound Name8-aminooctan-1-ol;1,3-oxazolidine
PubChem CID70474825
Molecular FormulaC11H26N2O2
Molecular Weight218.34 g/mol
Exact Mass218.20
IUPAC Name8-aminooctan-1-ol;1,3-oxazolidine
SMILESC1COCN1.NCCCCCCCCO
InChIInChI=1S/C8H19NO.C3H7NO/c9-7-5-3-1-2-4-6-8-10;1-2-5-3-4-1/h10H,1-9H2;4H,1-3H2
InChIKeyUUBTVANHAVVQQT-UHFFFAOYSA-N
XLogP0.84
TPSA67.51 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 50.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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 8-aminooctan-1-ol;1,3-oxazolidine?
The IUPAC name of 8-aminooctan-1-ol;1,3-oxazolidine (CID 70474825) is 8-aminooctan-1-ol;1,3-oxazolidine.
What is the SMILES notation for 8-aminooctan-1-ol;1,3-oxazolidine?
The canonical SMILES for 8-aminooctan-1-ol;1,3-oxazolidine is C1COCN1.NCCCCCCCCO.
What is the InChIKey of 8-aminooctan-1-ol;1,3-oxazolidine?
The InChIKey is UUBTVANHAVVQQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO.C3H7NO/c9-7-5-3-1-2-4-6-8-10;1-2-5-3-4-1/h10H,1-9H2;4H,1-3H2.
What are the key properties of 8-aminooctan-1-ol;1,3-oxazolidine?
8-aminooctan-1-ol;1,3-oxazolidine has a molecular weight of 218.34 g/mol, XLogP of 0.84, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-aminooctan-1-ol;1,3-oxazolidine is sourced from PubChem (CID 70474825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).