1-(2-hydroxyphenyl)-3-phenylurea

C13H12N2O2 — CID 4614441

IUPAC1-(2-hydroxyphenyl)-3-phenylurea
SMILESO=C(Nc1ccccc1)Nc1ccccc1O
InChIInChI=1S/C13H12N2O2/c16-12-9-5-4-8-11(12)15-13(17)14-10-6-2-1-3-7-10/h1-9,16H,(H2,14,15,17)
InChIKeySOTPAHSLPCKYOC-UHFFFAOYSA-N
MW228.25 g/mol
LogP3.04
Rot. Bonds2

About 1-(2-hydroxyphenyl)-3-phenylurea

1-(2-hydroxyphenyl)-3-phenylurea (PubChem CID 4614441) has the molecular formula C13H12N2O2 and a molecular weight of 228.25 g/mol. Its IUPAC name is 1-(2-hydroxyphenyl)-3-phenylurea.

Molecular Properties

Compound Name1-(2-hydroxyphenyl)-3-phenylurea
PubChem CID4614441
Molecular FormulaC13H12N2O2
Molecular Weight228.25 g/mol
Exact Mass228.09
IUPAC Name1-(2-hydroxyphenyl)-3-phenylurea
SMILESO=C(Nc1ccccc1)Nc1ccccc1O
InChIInChI=1S/C13H12N2O2/c16-12-9-5-4-8-11(12)15-13(17)14-10-6-2-1-3-7-10/h1-9,16H,(H2,14,15,17)
InChIKeySOTPAHSLPCKYOC-UHFFFAOYSA-N
XLogP3.04
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 53.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyphenyl)-3-phenylurea?
The IUPAC name of 1-(2-hydroxyphenyl)-3-phenylurea (CID 4614441) is 1-(2-hydroxyphenyl)-3-phenylurea.
What is the SMILES notation for 1-(2-hydroxyphenyl)-3-phenylurea?
The canonical SMILES for 1-(2-hydroxyphenyl)-3-phenylurea is O=C(Nc1ccccc1)Nc1ccccc1O.
What is the InChIKey of 1-(2-hydroxyphenyl)-3-phenylurea?
The InChIKey is SOTPAHSLPCKYOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O2/c16-12-9-5-4-8-11(12)15-13(17)14-10-6-2-1-3-7-10/h1-9,16H,(H2,14,15,17).
What are the key properties of 1-(2-hydroxyphenyl)-3-phenylurea?
1-(2-hydroxyphenyl)-3-phenylurea has a molecular weight of 228.25 g/mol, XLogP of 3.04, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyphenyl)-3-phenylurea is sourced from PubChem (CID 4614441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).