(4-chloro-2,6-difluorophenyl)urea

C7H5ClF2N2O — CID 59083606

IUPAC(4-chloro-2,6-difluorophenyl)urea
SMILESNC(=O)Nc1c(F)cc(Cl)cc1F
InChIInChI=1S/C7H5ClF2N2O/c8-3-1-4(9)6(5(10)2-3)12-7(11)13/h1-2H,(H3,11,12,13)
InChIKeyLFDJPZFGBLLASL-UHFFFAOYSA-N
MW206.58 g/mol
LogP2.11
Rot. Bonds1

About (4-chloro-2,6-difluorophenyl)urea

(4-chloro-2,6-difluorophenyl)urea (PubChem CID 59083606) has the molecular formula C7H5ClF2N2O and a molecular weight of 206.58 g/mol. Its IUPAC name is (4-chloro-2,6-difluorophenyl)urea.

Molecular Properties

Compound Name(4-chloro-2,6-difluorophenyl)urea
PubChem CID59083606
Molecular FormulaC7H5ClF2N2O
Molecular Weight206.58 g/mol
Exact Mass206.01
IUPAC Name(4-chloro-2,6-difluorophenyl)urea
SMILESNC(=O)Nc1c(F)cc(Cl)cc1F
InChIInChI=1S/C7H5ClF2N2O/c8-3-1-4(9)6(5(10)2-3)12-7(11)13/h1-2H,(H3,11,12,13)
InChIKeyLFDJPZFGBLLASL-UHFFFAOYSA-N
XLogP2.11
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.58
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

4-chloro-2,6-difluorobenzamide
CID 22478130
(2-bromo-4,6-difluorophenyl)urea
CID 43347715
(4-chloro-2,6-difluorophenyl)hydrazine;hydrochloride
CID 75480868
(2-bromo-6-fluoro-4-methylphenyl)urea
CID 141173640
2,5-dichloro-3-fluorobenzamide
CID 121228309
4-chloro-2,6-difluoro-N-methylaniline
CID 21161260
(3-amino-4-fluorophenyl)urea
CID 16776521
1,3-bis(2,4,6-trifluorophenyl)urea
CID 11716736
[3-[(4-chloro-2-fluorophenyl)sulfonylamino]phenyl]urea
CID 36510536
(2-bromo-4-chlorophenyl)urea
CID 81003362
N-(4-amino-2-chloro-6-fluorophenyl)acetamide
CID 2779532
2-[2-(carbamoylamino)-4-chlorophenyl]prop-2-enoic acid
CID 86606867

Frequently Asked Questions

What is the IUPAC name of (4-chloro-2,6-difluorophenyl)urea?
The IUPAC name of (4-chloro-2,6-difluorophenyl)urea (CID 59083606) is (4-chloro-2,6-difluorophenyl)urea.
What is the SMILES notation for (4-chloro-2,6-difluorophenyl)urea?
The canonical SMILES for (4-chloro-2,6-difluorophenyl)urea is NC(=O)Nc1c(F)cc(Cl)cc1F.
What is the InChIKey of (4-chloro-2,6-difluorophenyl)urea?
The InChIKey is LFDJPZFGBLLASL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClF2N2O/c8-3-1-4(9)6(5(10)2-3)12-7(11)13/h1-2H,(H3,11,12,13).
What are the key properties of (4-chloro-2,6-difluorophenyl)urea?
(4-chloro-2,6-difluorophenyl)urea has a molecular weight of 206.58 g/mol, XLogP of 2.11, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-2,6-difluorophenyl)urea is sourced from PubChem (CID 59083606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).