1-[2-(2-fluorophenoxy)ethyl]-3-phenylurea

C15H15FN2O2 — CID 43010864

IUPAC1-[2-(2-fluorophenoxy)ethyl]-3-phenylurea
SMILESO=C(NCCOc1ccccc1F)Nc1ccccc1
InChIInChI=1S/C15H15FN2O2/c16-13-8-4-5-9-14(13)20-11-10-17-15(19)18-12-6-2-1-3-7-12/h1-9H,10-11H2,(H2,17,18,19)
InChIKeyTYRZNDMLYLODKN-UHFFFAOYSA-N
MW274.30 g/mol
LogP3.03
Rot. Bonds5

About 1-[2-(2-fluorophenoxy)ethyl]-3-phenylurea

1-[2-(2-fluorophenoxy)ethyl]-3-phenylurea (PubChem CID 43010864) has the molecular formula C15H15FN2O2 and a molecular weight of 274.30 g/mol. Its IUPAC name is 1-[2-(2-fluorophenoxy)ethyl]-3-phenylurea.

Molecular Properties

Compound Name1-[2-(2-fluorophenoxy)ethyl]-3-phenylurea
PubChem CID43010864
Molecular FormulaC15H15FN2O2
Molecular Weight274.30 g/mol
Exact Mass274.11
IUPAC Name1-[2-(2-fluorophenoxy)ethyl]-3-phenylurea
SMILESO=C(NCCOc1ccccc1F)Nc1ccccc1
InChIInChI=1S/C15H15FN2O2/c16-13-8-4-5-9-14(13)20-11-10-17-15(19)18-12-6-2-1-3-7-12/h1-9H,10-11H2,(H2,17,18,19)
InChIKeyTYRZNDMLYLODKN-UHFFFAOYSA-N
XLogP3.03
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[2-(2-fluorophenoxy)ethyl]-3-(4-phenoxyphenyl)urea
CID 112970293
1-[2-(2-fluorophenoxy)ethyl]-3-pyridin-3-ylurea
CID 18101867
1-(3,5-dimethylphenyl)-3-[2-(2-fluorophenoxy)ethyl]urea
CID 112970237
1-(3-acetylphenyl)-3-[2-(2-fluorophenoxy)ethyl]urea
CID 112970277
1-[2-(2-fluorophenoxy)ethyl]-3-[3-(trifluoromethyl)phenyl]urea
CID 112970275
1-[2-(2-chlorophenoxy)ethyl]-3-phenylurea
CID 2972238
1-[2-(2-aminophenoxy)ethyl]-3-(4-fluorophenyl)urea
CID 61031635
1-(4-fluorophenyl)-3-(2-phenoxyethyl)urea
CID 27870148
1-[3-(2-methoxyphenoxy)propyl]-3-phenylurea
CID 91538470
1-[2-(2-fluorophenoxy)ethyl]-3-pentylurea
CID 112970219
N-[2-(2-fluorophenoxy)ethyl]-2-methylpropanamide
CID 110478459
1-[2-(2-chlorophenoxy)ethyl]-3-(3-fluorophenyl)urea
CID 112970688

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-fluorophenoxy)ethyl]-3-phenylurea?
The IUPAC name of 1-[2-(2-fluorophenoxy)ethyl]-3-phenylurea (CID 43010864) is 1-[2-(2-fluorophenoxy)ethyl]-3-phenylurea.
What is the SMILES notation for 1-[2-(2-fluorophenoxy)ethyl]-3-phenylurea?
The canonical SMILES for 1-[2-(2-fluorophenoxy)ethyl]-3-phenylurea is O=C(NCCOc1ccccc1F)Nc1ccccc1.
What is the InChIKey of 1-[2-(2-fluorophenoxy)ethyl]-3-phenylurea?
The InChIKey is TYRZNDMLYLODKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O2/c16-13-8-4-5-9-14(13)20-11-10-17-15(19)18-12-6-2-1-3-7-12/h1-9H,10-11H2,(H2,17,18,19).
What are the key properties of 1-[2-(2-fluorophenoxy)ethyl]-3-phenylurea?
1-[2-(2-fluorophenoxy)ethyl]-3-phenylurea has a molecular weight of 274.30 g/mol, XLogP of 3.03, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-fluorophenoxy)ethyl]-3-phenylurea is sourced from PubChem (CID 43010864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).