(2-fluorophenyl)urea

C7H7FN2O — CID 12606

IUPAC(2-fluorophenyl)urea
SMILESNC(=O)Nc1ccccc1F
InChIInChI=1S/C7H7FN2O/c8-5-3-1-2-4-6(5)10-7(9)11/h1-4H,(H3,9,10,11)
InChIKeyPAWVOCWEWJXILY-UHFFFAOYSA-N
MW154.14 g/mol
LogP1.32
Rot. Bonds1

About (2-fluorophenyl)urea

(2-fluorophenyl)urea (PubChem CID 12606) has the molecular formula C7H7FN2O and a molecular weight of 154.14 g/mol. Its IUPAC name is (2-fluorophenyl)urea.

Molecular Properties

Compound Name(2-fluorophenyl)urea
PubChem CID12606
Molecular FormulaC7H7FN2O
Molecular Weight154.14 g/mol
Exact Mass154.05
IUPAC Name(2-fluorophenyl)urea
SMILESNC(=O)Nc1ccccc1F
InChIInChI=1S/C7H7FN2O/c8-5-3-1-2-4-6(5)10-7(9)11/h1-4H,(H3,9,10,11)
InChIKeyPAWVOCWEWJXILY-UHFFFAOYSA-N
XLogP1.32
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.14
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2-fluorophenyl)urea?
The IUPAC name of (2-fluorophenyl)urea (CID 12606) is (2-fluorophenyl)urea.
What is the SMILES notation for (2-fluorophenyl)urea?
The canonical SMILES for (2-fluorophenyl)urea is NC(=O)Nc1ccccc1F.
What is the InChIKey of (2-fluorophenyl)urea?
The InChIKey is PAWVOCWEWJXILY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7FN2O/c8-5-3-1-2-4-6(5)10-7(9)11/h1-4H,(H3,9,10,11).
What are the key properties of (2-fluorophenyl)urea?
(2-fluorophenyl)urea has a molecular weight of 154.14 g/mol, XLogP of 1.32, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluorophenyl)urea is sourced from PubChem (CID 12606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).