5-amino-2-(morpholin-4-ylmethyl)phenol

C11H16N2O2 — CID 19799808

IUPAC5-amino-2-(morpholin-4-ylmethyl)phenol
SMILESNc1ccc(CN2CCOCC2)c(O)c1
InChIInChI=1S/C11H16N2O2/c12-10-2-1-9(11(14)7-10)8-13-3-5-15-6-4-13/h1-2,7,14H,3-6,8,12H2
InChIKeyYKLTUHSLVJVJDK-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.81
Rot. Bonds2

About 5-amino-2-(morpholin-4-ylmethyl)phenol

5-amino-2-(morpholin-4-ylmethyl)phenol (PubChem CID 19799808) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 5-amino-2-(morpholin-4-ylmethyl)phenol.

Molecular Properties

Compound Name5-amino-2-(morpholin-4-ylmethyl)phenol
PubChem CID19799808
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name5-amino-2-(morpholin-4-ylmethyl)phenol
SMILESNc1ccc(CN2CCOCC2)c(O)c1
InChIInChI=1S/C11H16N2O2/c12-10-2-1-9(11(14)7-10)8-13-3-5-15-6-4-13/h1-2,7,14H,3-6,8,12H2
InChIKeyYKLTUHSLVJVJDK-UHFFFAOYSA-N
XLogP0.81
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(morpholin-4-ylmethyl)phenol?
The IUPAC name of 5-amino-2-(morpholin-4-ylmethyl)phenol (CID 19799808) is 5-amino-2-(morpholin-4-ylmethyl)phenol.
What is the SMILES notation for 5-amino-2-(morpholin-4-ylmethyl)phenol?
The canonical SMILES for 5-amino-2-(morpholin-4-ylmethyl)phenol is Nc1ccc(CN2CCOCC2)c(O)c1.
What is the InChIKey of 5-amino-2-(morpholin-4-ylmethyl)phenol?
The InChIKey is YKLTUHSLVJVJDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c12-10-2-1-9(11(14)7-10)8-13-3-5-15-6-4-13/h1-2,7,14H,3-6,8,12H2.
What are the key properties of 5-amino-2-(morpholin-4-ylmethyl)phenol?
5-amino-2-(morpholin-4-ylmethyl)phenol has a molecular weight of 208.26 g/mol, XLogP of 0.81, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(morpholin-4-ylmethyl)phenol is sourced from PubChem (CID 19799808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).