1-(2-phenoxyphenyl)-3-phenylurea

C19H16N2O2 — CID 735813

IUPAC1-(2-phenoxyphenyl)-3-phenylurea
SMILESO=C(Nc1ccccc1)Nc1ccccc1Oc1ccccc1
InChIInChI=1S/C19H16N2O2/c22-19(20-15-9-3-1-4-10-15)21-17-13-7-8-14-18(17)23-16-11-5-2-6-12-16/h1-14H,(H2,20,21,22)
InChIKeyLXHSHYBTKORIMO-UHFFFAOYSA-N
MW304.35 g/mol
LogP5.12
Rot. Bonds4

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

1-(2-phenoxyphenyl)-3-phenylurea (PubChem CID 735813) has the molecular formula C19H16N2O2 and a molecular weight of 304.35 g/mol. Its IUPAC name is 1-(2-phenoxyphenyl)-3-phenylurea.

Molecular Properties

Compound Name1-(2-phenoxyphenyl)-3-phenylurea
PubChem CID735813
Molecular FormulaC19H16N2O2
Molecular Weight304.35 g/mol
Exact Mass304.12
IUPAC Name1-(2-phenoxyphenyl)-3-phenylurea
SMILESO=C(Nc1ccccc1)Nc1ccccc1Oc1ccccc1
InChIInChI=1S/C19H16N2O2/c22-19(20-15-9-3-1-4-10-15)21-17-13-7-8-14-18(17)23-16-11-5-2-6-12-16/h1-14H,(H2,20,21,22)
InChIKeyLXHSHYBTKORIMO-UHFFFAOYSA-N
XLogP5.12
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.35
LogP ≤ 55.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-phenoxyphenyl)-3-phenylurea?
The IUPAC name of 1-(2-phenoxyphenyl)-3-phenylurea (CID 735813) is 1-(2-phenoxyphenyl)-3-phenylurea.
What is the SMILES notation for 1-(2-phenoxyphenyl)-3-phenylurea?
The canonical SMILES for 1-(2-phenoxyphenyl)-3-phenylurea is O=C(Nc1ccccc1)Nc1ccccc1Oc1ccccc1.
What is the InChIKey of 1-(2-phenoxyphenyl)-3-phenylurea?
The InChIKey is LXHSHYBTKORIMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O2/c22-19(20-15-9-3-1-4-10-15)21-17-13-7-8-14-18(17)23-16-11-5-2-6-12-16/h1-14H,(H2,20,21,22).
What are the key properties of 1-(2-phenoxyphenyl)-3-phenylurea?
1-(2-phenoxyphenyl)-3-phenylurea has a molecular weight of 304.35 g/mol, XLogP of 5.12, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenoxyphenyl)-3-phenylurea is sourced from PubChem (CID 735813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).