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

C17H19N3O2 — CID 2813235

IUPAC1-(2-morpholin-4-ylphenyl)-3-phenylurea
SMILESO=C(Nc1ccccc1)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C17H19N3O2/c21-17(18-14-6-2-1-3-7-14)19-15-8-4-5-9-16(15)20-10-12-22-13-11-20/h1-9H,10-13H2,(H2,18,19,21)
InChIKeyRTFCOVWMHWUGIH-UHFFFAOYSA-N
MW297.36 g/mol
LogP3.17
Rot. Bonds3

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

1-(2-morpholin-4-ylphenyl)-3-phenylurea (PubChem CID 2813235) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is 1-(2-morpholin-4-ylphenyl)-3-phenylurea.

Molecular Properties

Compound Name1-(2-morpholin-4-ylphenyl)-3-phenylurea
PubChem CID2813235
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC Name1-(2-morpholin-4-ylphenyl)-3-phenylurea
SMILESO=C(Nc1ccccc1)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C17H19N3O2/c21-17(18-14-6-2-1-3-7-14)19-15-8-4-5-9-16(15)20-10-12-22-13-11-20/h1-9H,10-13H2,(H2,18,19,21)
InChIKeyRTFCOVWMHWUGIH-UHFFFAOYSA-N
XLogP3.17
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 53.17
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-ylphenyl)-3-phenylurea?
The IUPAC name of 1-(2-morpholin-4-ylphenyl)-3-phenylurea (CID 2813235) is 1-(2-morpholin-4-ylphenyl)-3-phenylurea.
What is the SMILES notation for 1-(2-morpholin-4-ylphenyl)-3-phenylurea?
The canonical SMILES for 1-(2-morpholin-4-ylphenyl)-3-phenylurea is O=C(Nc1ccccc1)Nc1ccccc1N1CCOCC1.
What is the InChIKey of 1-(2-morpholin-4-ylphenyl)-3-phenylurea?
The InChIKey is RTFCOVWMHWUGIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c21-17(18-14-6-2-1-3-7-14)19-15-8-4-5-9-16(15)20-10-12-22-13-11-20/h1-9H,10-13H2,(H2,18,19,21).
What are the key properties of 1-(2-morpholin-4-ylphenyl)-3-phenylurea?
1-(2-morpholin-4-ylphenyl)-3-phenylurea has a molecular weight of 297.36 g/mol, XLogP of 3.17, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-ylphenyl)-3-phenylurea is sourced from PubChem (CID 2813235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).