2-(4-morpholin-4-ylphenyl)ethanamine

C12H18N2O — CID 23009596

IUPAC2-(4-morpholin-4-ylphenyl)ethanamine
SMILESNCCc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C12H18N2O/c13-6-5-11-1-3-12(4-2-11)14-7-9-15-10-8-14/h1-4H,5-10,13H2
InChIKeyUSKPIYGGLOVZND-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.02
Rot. Bonds3

About 2-(4-morpholin-4-ylphenyl)ethanamine

2-(4-morpholin-4-ylphenyl)ethanamine (PubChem CID 23009596) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-(4-morpholin-4-ylphenyl)ethanamine.

Molecular Properties

Compound Name2-(4-morpholin-4-ylphenyl)ethanamine
PubChem CID23009596
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name2-(4-morpholin-4-ylphenyl)ethanamine
SMILESNCCc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C12H18N2O/c13-6-5-11-1-3-12(4-2-11)14-7-9-15-10-8-14/h1-4H,5-10,13H2
InChIKeyUSKPIYGGLOVZND-UHFFFAOYSA-N
XLogP1.02
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

2-[4-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-yl)phenyl]ethanamine
CID 170868542
2-[4-(1,4-oxazepan-4-yl)phenyl]ethanamine
CID 63786659
1-[4-(2-aminoethyl)phenyl]piperidin-4-ol
CID 83822441
4-(4-morpholin-4-ylphenyl)butan-2-amine
CID 23009589
N-methyl-2-(4-morpholin-4-ylphenyl)ethanamine
CID 82616430
2-(6-morpholin-4-yl-3-pyridinyl)ethanamine
CID 58882085
2-(3-fluoro-4-morpholin-4-ylphenyl)ethanamine
CID 63784903
(4-morpholin-4-ylphenyl)methanol
CID 2776456
4-(4-ethylphenyl)morpholine
CID 20576442
5-(4-morpholin-4-ylphenyl)pentanamide
CID 155168497
4-(4-prop-2-enylphenyl)morpholine
CID 70631563
4-(4-benzylphenyl)morpholine
CID 11514364

Frequently Asked Questions

What is the IUPAC name of 2-(4-morpholin-4-ylphenyl)ethanamine?
The IUPAC name of 2-(4-morpholin-4-ylphenyl)ethanamine (CID 23009596) is 2-(4-morpholin-4-ylphenyl)ethanamine.
What is the SMILES notation for 2-(4-morpholin-4-ylphenyl)ethanamine?
The canonical SMILES for 2-(4-morpholin-4-ylphenyl)ethanamine is NCCc1ccc(N2CCOCC2)cc1.
What is the InChIKey of 2-(4-morpholin-4-ylphenyl)ethanamine?
The InChIKey is USKPIYGGLOVZND-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c13-6-5-11-1-3-12(4-2-11)14-7-9-15-10-8-14/h1-4H,5-10,13H2.
What are the key properties of 2-(4-morpholin-4-ylphenyl)ethanamine?
2-(4-morpholin-4-ylphenyl)ethanamine has a molecular weight of 206.29 g/mol, XLogP of 1.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-morpholin-4-ylphenyl)ethanamine is sourced from PubChem (CID 23009596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).