O-[(3-morpholin-4-ylphenyl)methyl]hydroxylamine

C11H16N2O2 — CID 117297788

IUPACO-[(3-morpholin-4-ylphenyl)methyl]hydroxylamine
SMILESNOCc1cccc(N2CCOCC2)c1
InChIInChI=1S/C11H16N2O2/c12-15-9-10-2-1-3-11(8-10)13-4-6-14-7-5-13/h1-3,8H,4-7,9,12H2
InChIKeyMKKFBBPLZRDGFU-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.91
Rot. Bonds3

About O-[(3-morpholin-4-ylphenyl)methyl]hydroxylamine

O-[(3-morpholin-4-ylphenyl)methyl]hydroxylamine (PubChem CID 117297788) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is O-[(3-morpholin-4-ylphenyl)methyl]hydroxylamine.

Molecular Properties

Compound NameO-[(3-morpholin-4-ylphenyl)methyl]hydroxylamine
PubChem CID117297788
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC NameO-[(3-morpholin-4-ylphenyl)methyl]hydroxylamine
SMILESNOCc1cccc(N2CCOCC2)c1
InChIInChI=1S/C11H16N2O2/c12-15-9-10-2-1-3-11(8-10)13-4-6-14-7-5-13/h1-3,8H,4-7,9,12H2
InChIKeyMKKFBBPLZRDGFU-UHFFFAOYSA-N
XLogP0.91
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of O-[(3-morpholin-4-ylphenyl)methyl]hydroxylamine?
The IUPAC name of O-[(3-morpholin-4-ylphenyl)methyl]hydroxylamine (CID 117297788) is O-[(3-morpholin-4-ylphenyl)methyl]hydroxylamine.
What is the SMILES notation for O-[(3-morpholin-4-ylphenyl)methyl]hydroxylamine?
The canonical SMILES for O-[(3-morpholin-4-ylphenyl)methyl]hydroxylamine is NOCc1cccc(N2CCOCC2)c1.
What is the InChIKey of O-[(3-morpholin-4-ylphenyl)methyl]hydroxylamine?
The InChIKey is MKKFBBPLZRDGFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c12-15-9-10-2-1-3-11(8-10)13-4-6-14-7-5-13/h1-3,8H,4-7,9,12H2.
What are the key properties of O-[(3-morpholin-4-ylphenyl)methyl]hydroxylamine?
O-[(3-morpholin-4-ylphenyl)methyl]hydroxylamine has a molecular weight of 208.26 g/mol, XLogP of 0.91, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for O-[(3-morpholin-4-ylphenyl)methyl]hydroxylamine is sourced from PubChem (CID 117297788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).