(NE)-N-[(4-morpholin-4-ylphenyl)methylidene]hydroxylamine

C11H14N2O2 — CID 6898269

IUPAC(NE)-N-[(4-morpholin-4-ylphenyl)methylidene]hydroxylamine
SMILESO/N=C/c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C11H14N2O2/c14-12-9-10-1-3-11(4-2-10)13-5-7-15-8-6-13/h1-4,9,14H,5-8H2/b12-9+
InChIKeyCOWCZKTVODJKQZ-FMIVXFBMSA-N
MW206.25 g/mol
LogP1.33
Rot. Bonds2

About (NE)-N-[(4-morpholin-4-ylphenyl)methylidene]hydroxylamine

(NE)-N-[(4-morpholin-4-ylphenyl)methylidene]hydroxylamine (PubChem CID 6898269) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is (NE)-N-[(4-morpholin-4-ylphenyl)methylidene]hydroxylamine.

Molecular Properties

Compound Name(NE)-N-[(4-morpholin-4-ylphenyl)methylidene]hydroxylamine
PubChem CID6898269
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC Name(NE)-N-[(4-morpholin-4-ylphenyl)methylidene]hydroxylamine
SMILESO/N=C/c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C11H14N2O2/c14-12-9-10-1-3-11(4-2-10)13-5-7-15-8-6-13/h1-4,9,14H,5-8H2/b12-9+
InChIKeyCOWCZKTVODJKQZ-FMIVXFBMSA-N
XLogP1.33
TPSA45.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (NE)-N-[(4-morpholin-4-ylphenyl)methylidene]hydroxylamine?
The IUPAC name of (NE)-N-[(4-morpholin-4-ylphenyl)methylidene]hydroxylamine (CID 6898269) is (NE)-N-[(4-morpholin-4-ylphenyl)methylidene]hydroxylamine.
What is the SMILES notation for (NE)-N-[(4-morpholin-4-ylphenyl)methylidene]hydroxylamine?
The canonical SMILES for (NE)-N-[(4-morpholin-4-ylphenyl)methylidene]hydroxylamine is O/N=C/c1ccc(N2CCOCC2)cc1.
What is the InChIKey of (NE)-N-[(4-morpholin-4-ylphenyl)methylidene]hydroxylamine?
The InChIKey is COWCZKTVODJKQZ-FMIVXFBMSA-N. The full InChI is InChI=1S/C11H14N2O2/c14-12-9-10-1-3-11(4-2-10)13-5-7-15-8-6-13/h1-4,9,14H,5-8H2/b12-9+.
What are the key properties of (NE)-N-[(4-morpholin-4-ylphenyl)methylidene]hydroxylamine?
(NE)-N-[(4-morpholin-4-ylphenyl)methylidene]hydroxylamine has a molecular weight of 206.25 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NE)-N-[(4-morpholin-4-ylphenyl)methylidene]hydroxylamine is sourced from PubChem (CID 6898269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).