1-(4-fluorophenyl)ethylurea

C9H11FN2O — CID 23074113

IUPAC1-(4-fluorophenyl)ethylurea
SMILESCC(NC(N)=O)c1ccc(F)cc1
InChIInChI=1S/C9H11FN2O/c1-6(12-9(11)13)7-2-4-8(10)5-3-7/h2-6H,1H3,(H3,11,12,13)
InChIKeyUTVPMSWKZMMHFU-UHFFFAOYSA-N
MW182.20 g/mol
LogP1.55
Rot. Bonds2

About 1-(4-fluorophenyl)ethylurea

1-(4-fluorophenyl)ethylurea (PubChem CID 23074113) has the molecular formula C9H11FN2O and a molecular weight of 182.20 g/mol. Its IUPAC name is 1-(4-fluorophenyl)ethylurea.

Molecular Properties

Compound Name1-(4-fluorophenyl)ethylurea
PubChem CID23074113
Molecular FormulaC9H11FN2O
Molecular Weight182.20 g/mol
Exact Mass182.09
IUPAC Name1-(4-fluorophenyl)ethylurea
SMILESCC(NC(N)=O)c1ccc(F)cc1
InChIInChI=1S/C9H11FN2O/c1-6(12-9(11)13)7-2-4-8(10)5-3-7/h2-6H,1H3,(H3,11,12,13)
InChIKeyUTVPMSWKZMMHFU-UHFFFAOYSA-N
XLogP1.55
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.20
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 1-(4-fluorophenyl)ethylurea with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)ethylurea?
The IUPAC name of 1-(4-fluorophenyl)ethylurea (CID 23074113) is 1-(4-fluorophenyl)ethylurea.
What is the SMILES notation for 1-(4-fluorophenyl)ethylurea?
The canonical SMILES for 1-(4-fluorophenyl)ethylurea is CC(NC(N)=O)c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)ethylurea?
The InChIKey is UTVPMSWKZMMHFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FN2O/c1-6(12-9(11)13)7-2-4-8(10)5-3-7/h2-6H,1H3,(H3,11,12,13).
What are the key properties of 1-(4-fluorophenyl)ethylurea?
1-(4-fluorophenyl)ethylurea has a molecular weight of 182.20 g/mol, XLogP of 1.55, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)ethylurea is sourced from PubChem (CID 23074113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).