1-(1,2-oxazol-5-yl)-3-phenylurea

C10H9N3O2 — CID 2744683

IUPAC1-(1,2-oxazol-5-yl)-3-phenylurea
SMILESO=C(Nc1ccccc1)Nc1ccno1
InChIInChI=1S/C10H9N3O2/c14-10(13-9-6-7-11-15-9)12-8-4-2-1-3-5-8/h1-7H,(H2,12,13,14)
InChIKeyVJPYKJWBSKLGCW-UHFFFAOYSA-N
MW203.20 g/mol
LogP2.32
Rot. Bonds2

About 1-(1,2-oxazol-5-yl)-3-phenylurea

1-(1,2-oxazol-5-yl)-3-phenylurea (PubChem CID 2744683) has the molecular formula C10H9N3O2 and a molecular weight of 203.20 g/mol. Its IUPAC name is 1-(1,2-oxazol-5-yl)-3-phenylurea.

Molecular Properties

Compound Name1-(1,2-oxazol-5-yl)-3-phenylurea
PubChem CID2744683
Molecular FormulaC10H9N3O2
Molecular Weight203.20 g/mol
Exact Mass203.07
IUPAC Name1-(1,2-oxazol-5-yl)-3-phenylurea
SMILESO=C(Nc1ccccc1)Nc1ccno1
InChIInChI=1S/C10H9N3O2/c14-10(13-9-6-7-11-15-9)12-8-4-2-1-3-5-8/h1-7H,(H2,12,13,14)
InChIKeyVJPYKJWBSKLGCW-UHFFFAOYSA-N
XLogP2.32
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1,2-oxazol-5-yl)-3-phenylurea?
The IUPAC name of 1-(1,2-oxazol-5-yl)-3-phenylurea (CID 2744683) is 1-(1,2-oxazol-5-yl)-3-phenylurea.
What is the SMILES notation for 1-(1,2-oxazol-5-yl)-3-phenylurea?
The canonical SMILES for 1-(1,2-oxazol-5-yl)-3-phenylurea is O=C(Nc1ccccc1)Nc1ccno1.
What is the InChIKey of 1-(1,2-oxazol-5-yl)-3-phenylurea?
The InChIKey is VJPYKJWBSKLGCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O2/c14-10(13-9-6-7-11-15-9)12-8-4-2-1-3-5-8/h1-7H,(H2,12,13,14).
What are the key properties of 1-(1,2-oxazol-5-yl)-3-phenylurea?
1-(1,2-oxazol-5-yl)-3-phenylurea has a molecular weight of 203.20 g/mol, XLogP of 2.32, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2-oxazol-5-yl)-3-phenylurea is sourced from PubChem (CID 2744683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).