1-(2-morpholin-4-ylethyl)-3-phenylurea

C13H19N3O2 — CID 2166263

IUPAC1-(2-morpholin-4-ylethyl)-3-phenylurea
SMILESO=C(NCCN1CCOCC1)Nc1ccccc1
InChIInChI=1S/C13H19N3O2/c17-13(15-12-4-2-1-3-5-12)14-6-7-16-8-10-18-11-9-16/h1-5H,6-11H2,(H2,14,15,17)
InChIKeyOULIWMYTLUFJKL-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.14
Rot. Bonds4

About 1-(2-morpholin-4-ylethyl)-3-phenylurea

1-(2-morpholin-4-ylethyl)-3-phenylurea (PubChem CID 2166263) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 1-(2-morpholin-4-ylethyl)-3-phenylurea.

Molecular Properties

Compound Name1-(2-morpholin-4-ylethyl)-3-phenylurea
PubChem CID2166263
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name1-(2-morpholin-4-ylethyl)-3-phenylurea
SMILESO=C(NCCN1CCOCC1)Nc1ccccc1
InChIInChI=1S/C13H19N3O2/c17-13(15-12-4-2-1-3-5-12)14-6-7-16-8-10-18-11-9-16/h1-5H,6-11H2,(H2,14,15,17)
InChIKeyOULIWMYTLUFJKL-UHFFFAOYSA-N
XLogP1.14
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-ylethyl)-3-phenylurea?
The IUPAC name of 1-(2-morpholin-4-ylethyl)-3-phenylurea (CID 2166263) is 1-(2-morpholin-4-ylethyl)-3-phenylurea.
What is the SMILES notation for 1-(2-morpholin-4-ylethyl)-3-phenylurea?
The canonical SMILES for 1-(2-morpholin-4-ylethyl)-3-phenylurea is O=C(NCCN1CCOCC1)Nc1ccccc1.
What is the InChIKey of 1-(2-morpholin-4-ylethyl)-3-phenylurea?
The InChIKey is OULIWMYTLUFJKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c17-13(15-12-4-2-1-3-5-12)14-6-7-16-8-10-18-11-9-16/h1-5H,6-11H2,(H2,14,15,17).
What are the key properties of 1-(2-morpholin-4-ylethyl)-3-phenylurea?
1-(2-morpholin-4-ylethyl)-3-phenylurea has a molecular weight of 249.31 g/mol, XLogP of 1.14, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-ylethyl)-3-phenylurea is sourced from PubChem (CID 2166263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).