1-hydroxy-1-[1-(4-phenylphenyl)ethyl]urea

C15H16N2O2 — CID 10538999

IUPAC1-hydroxy-1-[1-(4-phenylphenyl)ethyl]urea
SMILESCC(c1ccc(-c2ccccc2)cc1)N(O)C(N)=O
InChIInChI=1S/C15H16N2O2/c1-11(17(19)15(16)18)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h2-11,19H,1H3,(H2,16,18)
InChIKeyULSOEBPDGJHRSW-UHFFFAOYSA-N
MW256.31 g/mol
LogP3.18
Rot. Bonds3

About 1-hydroxy-1-[1-(4-phenylphenyl)ethyl]urea

1-hydroxy-1-[1-(4-phenylphenyl)ethyl]urea (PubChem CID 10538999) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 1-hydroxy-1-[1-(4-phenylphenyl)ethyl]urea.

Molecular Properties

Compound Name1-hydroxy-1-[1-(4-phenylphenyl)ethyl]urea
PubChem CID10538999
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name1-hydroxy-1-[1-(4-phenylphenyl)ethyl]urea
SMILESCC(c1ccc(-c2ccccc2)cc1)N(O)C(N)=O
InChIInChI=1S/C15H16N2O2/c1-11(17(19)15(16)18)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h2-11,19H,1H3,(H2,16,18)
InChIKeyULSOEBPDGJHRSW-UHFFFAOYSA-N
XLogP3.18
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-1-[1-(4-phenylphenyl)ethyl]urea?
The IUPAC name of 1-hydroxy-1-[1-(4-phenylphenyl)ethyl]urea (CID 10538999) is 1-hydroxy-1-[1-(4-phenylphenyl)ethyl]urea.
What is the SMILES notation for 1-hydroxy-1-[1-(4-phenylphenyl)ethyl]urea?
The canonical SMILES for 1-hydroxy-1-[1-(4-phenylphenyl)ethyl]urea is CC(c1ccc(-c2ccccc2)cc1)N(O)C(N)=O.
What is the InChIKey of 1-hydroxy-1-[1-(4-phenylphenyl)ethyl]urea?
The InChIKey is ULSOEBPDGJHRSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-11(17(19)15(16)18)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h2-11,19H,1H3,(H2,16,18).
What are the key properties of 1-hydroxy-1-[1-(4-phenylphenyl)ethyl]urea?
1-hydroxy-1-[1-(4-phenylphenyl)ethyl]urea has a molecular weight of 256.31 g/mol, XLogP of 3.18, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-1-[1-(4-phenylphenyl)ethyl]urea is sourced from PubChem (CID 10538999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).