5-(3,5-dimethylmorpholin-4-yl)pentan-1-ol

C11H23NO2 — CID 111452494

IUPAC5-(3,5-dimethylmorpholin-4-yl)pentan-1-ol
SMILESCC1COCC(C)N1CCCCCO
InChIInChI=1S/C11H23NO2/c1-10-8-14-9-11(2)12(10)6-4-3-5-7-13/h10-11,13H,3-9H2,1-2H3
InChIKeyLYDZHLCXYAQZDP-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.26
Rot. Bonds5

About 5-(3,5-dimethylmorpholin-4-yl)pentan-1-ol

5-(3,5-dimethylmorpholin-4-yl)pentan-1-ol (PubChem CID 111452494) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 5-(3,5-dimethylmorpholin-4-yl)pentan-1-ol.

Molecular Properties

Compound Name5-(3,5-dimethylmorpholin-4-yl)pentan-1-ol
PubChem CID111452494
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name5-(3,5-dimethylmorpholin-4-yl)pentan-1-ol
SMILESCC1COCC(C)N1CCCCCO
InChIInChI=1S/C11H23NO2/c1-10-8-14-9-11(2)12(10)6-4-3-5-7-13/h10-11,13H,3-9H2,1-2H3
InChIKeyLYDZHLCXYAQZDP-UHFFFAOYSA-N
XLogP1.26
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.26
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-(3,5-dimethylmorpholin-4-yl)pentan-1-ol?
The IUPAC name of 5-(3,5-dimethylmorpholin-4-yl)pentan-1-ol (CID 111452494) is 5-(3,5-dimethylmorpholin-4-yl)pentan-1-ol.
What is the SMILES notation for 5-(3,5-dimethylmorpholin-4-yl)pentan-1-ol?
The canonical SMILES for 5-(3,5-dimethylmorpholin-4-yl)pentan-1-ol is CC1COCC(C)N1CCCCCO.
What is the InChIKey of 5-(3,5-dimethylmorpholin-4-yl)pentan-1-ol?
The InChIKey is LYDZHLCXYAQZDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-10-8-14-9-11(2)12(10)6-4-3-5-7-13/h10-11,13H,3-9H2,1-2H3.
What are the key properties of 5-(3,5-dimethylmorpholin-4-yl)pentan-1-ol?
5-(3,5-dimethylmorpholin-4-yl)pentan-1-ol has a molecular weight of 201.31 g/mol, XLogP of 1.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-dimethylmorpholin-4-yl)pentan-1-ol is sourced from PubChem (CID 111452494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).