5-(3-methylmorpholin-4-yl)pentan-1-ol

C10H21NO2 — CID 62228408

IUPAC5-(3-methylmorpholin-4-yl)pentan-1-ol
SMILESCC1COCCN1CCCCCO
InChIInChI=1S/C10H21NO2/c1-10-9-13-8-6-11(10)5-3-2-4-7-12/h10,12H,2-9H2,1H3
InChIKeyWOMDIWYDFROROC-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.87
Rot. Bonds5

About 5-(3-methylmorpholin-4-yl)pentan-1-ol

5-(3-methylmorpholin-4-yl)pentan-1-ol (PubChem CID 62228408) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 5-(3-methylmorpholin-4-yl)pentan-1-ol.

Molecular Properties

Compound Name5-(3-methylmorpholin-4-yl)pentan-1-ol
PubChem CID62228408
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name5-(3-methylmorpholin-4-yl)pentan-1-ol
SMILESCC1COCCN1CCCCCO
InChIInChI=1S/C10H21NO2/c1-10-9-13-8-6-11(10)5-3-2-4-7-12/h10,12H,2-9H2,1H3
InChIKeyWOMDIWYDFROROC-UHFFFAOYSA-N
XLogP0.87
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.87
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-methylmorpholin-4-yl)pentan-1-ol?
The IUPAC name of 5-(3-methylmorpholin-4-yl)pentan-1-ol (CID 62228408) is 5-(3-methylmorpholin-4-yl)pentan-1-ol.
What is the SMILES notation for 5-(3-methylmorpholin-4-yl)pentan-1-ol?
The canonical SMILES for 5-(3-methylmorpholin-4-yl)pentan-1-ol is CC1COCCN1CCCCCO.
What is the InChIKey of 5-(3-methylmorpholin-4-yl)pentan-1-ol?
The InChIKey is WOMDIWYDFROROC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-10-9-13-8-6-11(10)5-3-2-4-7-12/h10,12H,2-9H2,1H3.
What are the key properties of 5-(3-methylmorpholin-4-yl)pentan-1-ol?
5-(3-methylmorpholin-4-yl)pentan-1-ol has a molecular weight of 187.28 g/mol, XLogP of 0.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methylmorpholin-4-yl)pentan-1-ol is sourced from PubChem (CID 62228408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).