9-morpholin-4-ylnonan-1-ol

C13H27NO2 — CID 58205558

IUPAC9-morpholin-4-ylnonan-1-ol
SMILESOCCCCCCCCCN1CCOCC1
InChIInChI=1S/C13H27NO2/c15-11-7-5-3-1-2-4-6-8-14-9-12-16-13-10-14/h15H,1-13H2
InChIKeyMSGGTROYDHBBBD-UHFFFAOYSA-N
MW229.36 g/mol
LogP2.04
Rot. Bonds9

About 9-morpholin-4-ylnonan-1-ol

9-morpholin-4-ylnonan-1-ol (PubChem CID 58205558) has the molecular formula C13H27NO2 and a molecular weight of 229.36 g/mol. Its IUPAC name is 9-morpholin-4-ylnonan-1-ol.

Molecular Properties

Compound Name9-morpholin-4-ylnonan-1-ol
PubChem CID58205558
Molecular FormulaC13H27NO2
Molecular Weight229.36 g/mol
Exact Mass229.20
IUPAC Name9-morpholin-4-ylnonan-1-ol
SMILESOCCCCCCCCCN1CCOCC1
InChIInChI=1S/C13H27NO2/c15-11-7-5-3-1-2-4-6-8-14-9-12-16-13-10-14/h15H,1-13H2
InChIKeyMSGGTROYDHBBBD-UHFFFAOYSA-N
XLogP2.04
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.36
LogP ≤ 52.04
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 9-morpholin-4-ylnonan-1-ol?
The IUPAC name of 9-morpholin-4-ylnonan-1-ol (CID 58205558) is 9-morpholin-4-ylnonan-1-ol.
What is the SMILES notation for 9-morpholin-4-ylnonan-1-ol?
The canonical SMILES for 9-morpholin-4-ylnonan-1-ol is OCCCCCCCCCN1CCOCC1.
What is the InChIKey of 9-morpholin-4-ylnonan-1-ol?
The InChIKey is MSGGTROYDHBBBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO2/c15-11-7-5-3-1-2-4-6-8-14-9-12-16-13-10-14/h15H,1-13H2.
What are the key properties of 9-morpholin-4-ylnonan-1-ol?
9-morpholin-4-ylnonan-1-ol has a molecular weight of 229.36 g/mol, XLogP of 2.04, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-morpholin-4-ylnonan-1-ol is sourced from PubChem (CID 58205558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).