2-morpholin-4-ylphenol

C10H13NO2 — CID 2795394

IUPAC2-morpholin-4-ylphenol
SMILESOc1ccccc1N1CCOCC1
InChIInChI=1S/C10H13NO2/c12-10-4-2-1-3-9(10)11-5-7-13-8-6-11/h1-4,12H,5-8H2
InChIKeyVMPYFWTYGZZUMY-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.23
Rot. Bonds1

About 2-morpholin-4-ylphenol

2-morpholin-4-ylphenol (PubChem CID 2795394) has the molecular formula C10H13NO2 and a molecular weight of 179.22 g/mol. Its IUPAC name is 2-morpholin-4-ylphenol.

Molecular Properties

Compound Name2-morpholin-4-ylphenol
PubChem CID2795394
Molecular FormulaC10H13NO2
Molecular Weight179.22 g/mol
Exact Mass179.09
IUPAC Name2-morpholin-4-ylphenol
SMILESOc1ccccc1N1CCOCC1
InChIInChI=1S/C10H13NO2/c12-10-4-2-1-3-9(10)11-5-7-13-8-6-11/h1-4,12H,5-8H2
InChIKeyVMPYFWTYGZZUMY-UHFFFAOYSA-N
XLogP1.23
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-ylphenol?
The IUPAC name of 2-morpholin-4-ylphenol (CID 2795394) is 2-morpholin-4-ylphenol.
What is the SMILES notation for 2-morpholin-4-ylphenol?
The canonical SMILES for 2-morpholin-4-ylphenol is Oc1ccccc1N1CCOCC1.
What is the InChIKey of 2-morpholin-4-ylphenol?
The InChIKey is VMPYFWTYGZZUMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2/c12-10-4-2-1-3-9(10)11-5-7-13-8-6-11/h1-4,12H,5-8H2.
What are the key properties of 2-morpholin-4-ylphenol?
2-morpholin-4-ylphenol has a molecular weight of 179.22 g/mol, XLogP of 1.23, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-ylphenol is sourced from PubChem (CID 2795394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).