(2-chloro-6-fluorophenyl)methoxyurea

C8H8ClFN2O2 — CID 1484515

IUPAC(2-chloro-6-fluorophenyl)methoxyurea
SMILESNC(=O)NOCc1c(F)cccc1Cl
InChIInChI=1S/C8H8ClFN2O2/c9-6-2-1-3-7(10)5(6)4-14-12-8(11)13/h1-3H,4H2,(H3,11,12,13)
InChIKeyNNFUZZPVLAZYBA-UHFFFAOYSA-N
MW218.62 g/mol
LogP1.58
Rot. Bonds3

About (2-chloro-6-fluorophenyl)methoxyurea

(2-chloro-6-fluorophenyl)methoxyurea (PubChem CID 1484515) has the molecular formula C8H8ClFN2O2 and a molecular weight of 218.62 g/mol. Its IUPAC name is (2-chloro-6-fluorophenyl)methoxyurea.

Molecular Properties

Compound Name(2-chloro-6-fluorophenyl)methoxyurea
PubChem CID1484515
Molecular FormulaC8H8ClFN2O2
Molecular Weight218.62 g/mol
Exact Mass218.03
IUPAC Name(2-chloro-6-fluorophenyl)methoxyurea
SMILESNC(=O)NOCc1c(F)cccc1Cl
InChIInChI=1S/C8H8ClFN2O2/c9-6-2-1-3-7(10)5(6)4-14-12-8(11)13/h1-3H,4H2,(H3,11,12,13)
InChIKeyNNFUZZPVLAZYBA-UHFFFAOYSA-N
XLogP1.58
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.62
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (2-chloro-6-fluorophenyl)methoxyurea 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 (2-chloro-6-fluorophenyl)methoxyurea?
The IUPAC name of (2-chloro-6-fluorophenyl)methoxyurea (CID 1484515) is (2-chloro-6-fluorophenyl)methoxyurea.
What is the SMILES notation for (2-chloro-6-fluorophenyl)methoxyurea?
The canonical SMILES for (2-chloro-6-fluorophenyl)methoxyurea is NC(=O)NOCc1c(F)cccc1Cl.
What is the InChIKey of (2-chloro-6-fluorophenyl)methoxyurea?
The InChIKey is NNFUZZPVLAZYBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClFN2O2/c9-6-2-1-3-7(10)5(6)4-14-12-8(11)13/h1-3H,4H2,(H3,11,12,13).
What are the key properties of (2-chloro-6-fluorophenyl)methoxyurea?
(2-chloro-6-fluorophenyl)methoxyurea has a molecular weight of 218.62 g/mol, XLogP of 1.58, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-6-fluorophenyl)methoxyurea is sourced from PubChem (CID 1484515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).