1-(2,6-difluorophenyl)-3-(4-ethylphenyl)urea

C15H14F2N2O — CID 108991509

IUPAC1-(2,6-difluorophenyl)-3-(4-ethylphenyl)urea
SMILESCCc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
InChIInChI=1S/C15H14F2N2O/c1-2-10-6-8-11(9-7-10)18-15(20)19-14-12(16)4-3-5-13(14)17/h3-9H,2H2,1H3,(H2,18,19,20)
InChIKeyCVHNMYCRCGSIIT-UHFFFAOYSA-N
MW276.29 g/mol
LogP4.17
Rot. Bonds3

About 1-(2,6-difluorophenyl)-3-(4-ethylphenyl)urea

1-(2,6-difluorophenyl)-3-(4-ethylphenyl)urea (PubChem CID 108991509) has the molecular formula C15H14F2N2O and a molecular weight of 276.29 g/mol. Its IUPAC name is 1-(2,6-difluorophenyl)-3-(4-ethylphenyl)urea.

Molecular Properties

Compound Name1-(2,6-difluorophenyl)-3-(4-ethylphenyl)urea
PubChem CID108991509
Molecular FormulaC15H14F2N2O
Molecular Weight276.29 g/mol
Exact Mass276.11
IUPAC Name1-(2,6-difluorophenyl)-3-(4-ethylphenyl)urea
SMILESCCc1ccc(NC(=O)Nc2c(F)cccc2F)cc1
InChIInChI=1S/C15H14F2N2O/c1-2-10-6-8-11(9-7-10)18-15(20)19-14-12(16)4-3-5-13(14)17/h3-9H,2H2,1H3,(H2,18,19,20)
InChIKeyCVHNMYCRCGSIIT-UHFFFAOYSA-N
XLogP4.17
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 54.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 1-(2,6-difluorophenyl)-3-(4-ethylphenyl)urea with MolForge

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

Launch Full Analysis

Related Compounds

1-(2,6-difluorophenyl)-3-(4-ethoxyphenyl)urea
CID 108874314
1-(4-aminophenyl)-3-(2,6-difluorophenyl)urea
CID 43469078
4-[(2,6-difluorophenyl)carbamoylamino]benzoic acid
CID 61196504
N-(4-ethylphenyl)-2-fluoro-6-hydroxybenzamide
CID 104916647
N-[4-[(2-chloro-6-fluorophenyl)carbamoylamino]phenyl]acetamide
CID 108896360
1-(4-ethylphenyl)-3-methylurea
CID 54250791
1-(2-chloro-6-fluorophenyl)-3-[1-(4-ethylphenyl)ethyl]urea
CID 108896439
2-[(4-ethylphenyl)carbamoylamino]-N-(2-fluorophenyl)acetamide
CID 772170
4-[(4-ethylphenyl)carbamoylamino]benzoic acid
CID 23551476
1-(4-tert-butylphenyl)-3-(4-ethylphenyl)urea
CID 58441349
ethane;1-(4-ethylphenyl)-3-methylurea
CID 143679761
1-(2,6-difluorophenyl)-3-(2,6-dimethylphenyl)urea
CID 108991420

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-difluorophenyl)-3-(4-ethylphenyl)urea?
The IUPAC name of 1-(2,6-difluorophenyl)-3-(4-ethylphenyl)urea (CID 108991509) is 1-(2,6-difluorophenyl)-3-(4-ethylphenyl)urea.
What is the SMILES notation for 1-(2,6-difluorophenyl)-3-(4-ethylphenyl)urea?
The canonical SMILES for 1-(2,6-difluorophenyl)-3-(4-ethylphenyl)urea is CCc1ccc(NC(=O)Nc2c(F)cccc2F)cc1.
What is the InChIKey of 1-(2,6-difluorophenyl)-3-(4-ethylphenyl)urea?
The InChIKey is CVHNMYCRCGSIIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O/c1-2-10-6-8-11(9-7-10)18-15(20)19-14-12(16)4-3-5-13(14)17/h3-9H,2H2,1H3,(H2,18,19,20).
What are the key properties of 1-(2,6-difluorophenyl)-3-(4-ethylphenyl)urea?
1-(2,6-difluorophenyl)-3-(4-ethylphenyl)urea has a molecular weight of 276.29 g/mol, XLogP of 4.17, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-difluorophenyl)-3-(4-ethylphenyl)urea is sourced from PubChem (CID 108991509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).