1-[(E)-2-(4-fluorophenyl)ethenyl]-3-phenylurea

C15H13FN2O — CID 108908068

IUPAC1-[(E)-2-(4-fluorophenyl)ethenyl]-3-phenylurea
SMILESO=C(N/C=C/c1ccc(F)cc1)Nc1ccccc1
InChIInChI=1S/C15H13FN2O/c16-13-8-6-12(7-9-13)10-11-17-15(19)18-14-4-2-1-3-5-14/h1-11H,(H2,17,18,19)/b11-10+
InChIKeyAMURETLHYZBXQB-ZHACJKMWSA-N
MW256.28 g/mol
LogP3.62
Rot. Bonds3

About 1-[(E)-2-(4-fluorophenyl)ethenyl]-3-phenylurea

1-[(E)-2-(4-fluorophenyl)ethenyl]-3-phenylurea (PubChem CID 108908068) has the molecular formula C15H13FN2O and a molecular weight of 256.28 g/mol. Its IUPAC name is 1-[(E)-2-(4-fluorophenyl)ethenyl]-3-phenylurea.

Molecular Properties

Compound Name1-[(E)-2-(4-fluorophenyl)ethenyl]-3-phenylurea
PubChem CID108908068
Molecular FormulaC15H13FN2O
Molecular Weight256.28 g/mol
Exact Mass256.10
IUPAC Name1-[(E)-2-(4-fluorophenyl)ethenyl]-3-phenylurea
SMILESO=C(N/C=C/c1ccc(F)cc1)Nc1ccccc1
InChIInChI=1S/C15H13FN2O/c16-13-8-6-12(7-9-13)10-11-17-15(19)18-14-4-2-1-3-5-14/h1-11H,(H2,17,18,19)/b11-10+
InChIKeyAMURETLHYZBXQB-ZHACJKMWSA-N
XLogP3.62
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.28
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 1-[(E)-2-(4-fluorophenyl)ethenyl]-3-phenylurea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3-fluorophenyl)-3-[(E)-2-phenylethenyl]urea
CID 108903344
1-(3,4-dichlorophenyl)-3-[(E)-2-(4-fluorophenyl)ethenyl]urea
CID 108907926
1-[(E)-2-(4-fluorophenyl)ethenyl]-3-(6-methyl-3-pyridinyl)urea
CID 108908260
N-(2-phenylethenylcarbamoyl)formamide
CID 174605369
1-(4-phenoxyphenyl)-3-[(E)-2-phenylethenyl]urea
CID 108903164
N-[3-[[(E)-2-phenylethenyl]carbamoylamino]phenyl]acetamide
CID 108903270
1-(2,4-difluorophenyl)-3-[(E)-2-(4-fluorophenyl)ethenyl]urea
CID 108908226
1-(3,4-dimethoxyphenyl)-3-[(E)-2-(4-fluorophenyl)ethenyl]urea
CID 108907908
1-[(E)-2-(4-fluorophenyl)ethenyl]-3-(2-nitrophenyl)urea
CID 108907912
1-[(E)-2-(4-fluorophenyl)ethenyl]-3-prop-2-enylurea
CID 108908110
1-[(2-chlorophenyl)methyl]-3-[(E)-2-(4-fluorophenyl)ethenyl]urea
CID 108907964
1-(4-fluorophenyl)-3-[4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenyl]urea
CID 71496034

Frequently Asked Questions

What is the IUPAC name of 1-[(E)-2-(4-fluorophenyl)ethenyl]-3-phenylurea?
The IUPAC name of 1-[(E)-2-(4-fluorophenyl)ethenyl]-3-phenylurea (CID 108908068) is 1-[(E)-2-(4-fluorophenyl)ethenyl]-3-phenylurea.
What is the SMILES notation for 1-[(E)-2-(4-fluorophenyl)ethenyl]-3-phenylurea?
The canonical SMILES for 1-[(E)-2-(4-fluorophenyl)ethenyl]-3-phenylurea is O=C(N/C=C/c1ccc(F)cc1)Nc1ccccc1.
What is the InChIKey of 1-[(E)-2-(4-fluorophenyl)ethenyl]-3-phenylurea?
The InChIKey is AMURETLHYZBXQB-ZHACJKMWSA-N. The full InChI is InChI=1S/C15H13FN2O/c16-13-8-6-12(7-9-13)10-11-17-15(19)18-14-4-2-1-3-5-14/h1-11H,(H2,17,18,19)/b11-10+.
What are the key properties of 1-[(E)-2-(4-fluorophenyl)ethenyl]-3-phenylurea?
1-[(E)-2-(4-fluorophenyl)ethenyl]-3-phenylurea has a molecular weight of 256.28 g/mol, XLogP of 3.62, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-2-(4-fluorophenyl)ethenyl]-3-phenylurea is sourced from PubChem (CID 108908068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).