(4-aminophenyl)-morpholin-4-ylmethanone

C11H14N2O2 — CID 577815

IUPAC(4-aminophenyl)-morpholin-4-ylmethanone
SMILESNc1ccc(C(=O)N2CCOCC2)cc1
InChIInChI=1S/C11H14N2O2/c12-10-3-1-9(2-4-10)11(14)13-5-7-15-8-6-13/h1-4H,5-8,12H2
InChIKeyWEHVQIQNGXWTME-UHFFFAOYSA-N
MW206.25 g/mol
LogP0.74
Rot. Bonds1

About (4-aminophenyl)-morpholin-4-ylmethanone

(4-aminophenyl)-morpholin-4-ylmethanone (PubChem CID 577815) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is (4-aminophenyl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(4-aminophenyl)-morpholin-4-ylmethanone
PubChem CID577815
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC Name(4-aminophenyl)-morpholin-4-ylmethanone
SMILESNc1ccc(C(=O)N2CCOCC2)cc1
InChIInChI=1S/C11H14N2O2/c12-10-3-1-9(2-4-10)11(14)13-5-7-15-8-6-13/h1-4H,5-8,12H2
InChIKeyWEHVQIQNGXWTME-UHFFFAOYSA-N
XLogP0.74
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (4-aminophenyl)-morpholin-4-ylmethanone?
The IUPAC name of (4-aminophenyl)-morpholin-4-ylmethanone (CID 577815) is (4-aminophenyl)-morpholin-4-ylmethanone.
What is the SMILES notation for (4-aminophenyl)-morpholin-4-ylmethanone?
The canonical SMILES for (4-aminophenyl)-morpholin-4-ylmethanone is Nc1ccc(C(=O)N2CCOCC2)cc1.
What is the InChIKey of (4-aminophenyl)-morpholin-4-ylmethanone?
The InChIKey is WEHVQIQNGXWTME-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c12-10-3-1-9(2-4-10)11(14)13-5-7-15-8-6-13/h1-4H,5-8,12H2.
What are the key properties of (4-aminophenyl)-morpholin-4-ylmethanone?
(4-aminophenyl)-morpholin-4-ylmethanone has a molecular weight of 206.25 g/mol, XLogP of 0.74, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminophenyl)-morpholin-4-ylmethanone is sourced from PubChem (CID 577815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).