4-[4-(2-morpholin-4-ylethyl)phenyl]-1,2-oxazol-5-amine

C15H19N3O2 — CID 117436130

IUPAC4-[4-(2-morpholin-4-ylethyl)phenyl]-1,2-oxazol-5-amine
SMILESNc1oncc1-c1ccc(CCN2CCOCC2)cc1
InChIInChI=1S/C15H19N3O2/c16-15-14(11-17-20-15)13-3-1-12(2-4-13)5-6-18-7-9-19-10-8-18/h1-4,11H,5-10,16H2
InChIKeyAJUIIIISQROILH-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.80
Rot. Bonds4

About 4-[4-(2-morpholin-4-ylethyl)phenyl]-1,2-oxazol-5-amine

4-[4-(2-morpholin-4-ylethyl)phenyl]-1,2-oxazol-5-amine (PubChem CID 117436130) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 4-[4-(2-morpholin-4-ylethyl)phenyl]-1,2-oxazol-5-amine.

Molecular Properties

Compound Name4-[4-(2-morpholin-4-ylethyl)phenyl]-1,2-oxazol-5-amine
PubChem CID117436130
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name4-[4-(2-morpholin-4-ylethyl)phenyl]-1,2-oxazol-5-amine
SMILESNc1oncc1-c1ccc(CCN2CCOCC2)cc1
InChIInChI=1S/C15H19N3O2/c16-15-14(11-17-20-15)13-3-1-12(2-4-13)5-6-18-7-9-19-10-8-18/h1-4,11H,5-10,16H2
InChIKeyAJUIIIISQROILH-UHFFFAOYSA-N
XLogP1.80
TPSA64.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(2-morpholin-4-ylethyl)phenyl]-1,2-oxazol-5-amine?
The IUPAC name of 4-[4-(2-morpholin-4-ylethyl)phenyl]-1,2-oxazol-5-amine (CID 117436130) is 4-[4-(2-morpholin-4-ylethyl)phenyl]-1,2-oxazol-5-amine.
What is the SMILES notation for 4-[4-(2-morpholin-4-ylethyl)phenyl]-1,2-oxazol-5-amine?
The canonical SMILES for 4-[4-(2-morpholin-4-ylethyl)phenyl]-1,2-oxazol-5-amine is Nc1oncc1-c1ccc(CCN2CCOCC2)cc1.
What is the InChIKey of 4-[4-(2-morpholin-4-ylethyl)phenyl]-1,2-oxazol-5-amine?
The InChIKey is AJUIIIISQROILH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c16-15-14(11-17-20-15)13-3-1-12(2-4-13)5-6-18-7-9-19-10-8-18/h1-4,11H,5-10,16H2.
What are the key properties of 4-[4-(2-morpholin-4-ylethyl)phenyl]-1,2-oxazol-5-amine?
4-[4-(2-morpholin-4-ylethyl)phenyl]-1,2-oxazol-5-amine has a molecular weight of 273.34 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(2-morpholin-4-ylethyl)phenyl]-1,2-oxazol-5-amine is sourced from PubChem (CID 117436130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).