1-(2,5-difluorophenyl)-3-(2-ethylphenyl)urea

C15H14F2N2O — CID 6465020

IUPAC1-(2,5-difluorophenyl)-3-(2-ethylphenyl)urea
SMILESCCc1ccccc1NC(=O)Nc1cc(F)ccc1F
InChIInChI=1S/C15H14F2N2O/c1-2-10-5-3-4-6-13(10)18-15(20)19-14-9-11(16)7-8-12(14)17/h3-9H,2H2,1H3,(H2,18,19,20)
InChIKeyKILDDABAUQNOMB-UHFFFAOYSA-N
MW276.29 g/mol
LogP4.17
Rot. Bonds3

About 1-(2,5-difluorophenyl)-3-(2-ethylphenyl)urea

1-(2,5-difluorophenyl)-3-(2-ethylphenyl)urea (PubChem CID 6465020) has the molecular formula C15H14F2N2O and a molecular weight of 276.29 g/mol. Its IUPAC name is 1-(2,5-difluorophenyl)-3-(2-ethylphenyl)urea.

Molecular Properties

Compound Name1-(2,5-difluorophenyl)-3-(2-ethylphenyl)urea
PubChem CID6465020
Molecular FormulaC15H14F2N2O
Molecular Weight276.29 g/mol
Exact Mass276.11
IUPAC Name1-(2,5-difluorophenyl)-3-(2-ethylphenyl)urea
SMILESCCc1ccccc1NC(=O)Nc1cc(F)ccc1F
InChIInChI=1S/C15H14F2N2O/c1-2-10-5-3-4-6-13(10)18-15(20)19-14-9-11(16)7-8-12(14)17/h3-9H,2H2,1H3,(H2,18,19,20)
InChIKeyKILDDABAUQNOMB-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

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Related Compounds

1-(2,5-difluorophenyl)-3-[(2-ethylphenoxy)methyl]urea
CID 108893476
N-(2-ethylphenyl)-5-fluoro-2-hydroxybenzamide
CID 115298874
1-N-(2,4-difluorophenyl)-4-N-(2-ethylphenyl)benzene-1,4-dicarboxamide
CID 109049743
1-(2,5-difluorophenyl)-3-pentan-3-ylurea
CID 47132779
1-[4-(diethylamino)phenyl]-3-(2,5-difluorophenyl)urea
CID 3383505
N-[2-(2-ethylanilino)-2-oxoethyl]-2,5-difluoro-N-methylbenzamide
CID 17413852
1-(3,5-dichlorophenyl)-3-(2-ethylphenyl)urea
CID 108991481
N-(2-ethyl-5-fluorophenyl)acetamide
CID 143900433
2-[(2-ethylphenyl)carbamoylamino]-N-(2-fluorophenyl)acetamide
CID 772197
1-(2-bromo-4-fluorophenyl)-3-(2,5-difluorophenyl)urea
CID 46860014
1-(2,5-difluorophenyl)-3-prop-1-en-2-ylurea
CID 108910441
1-(2-ethoxyphenyl)-3-(2-fluoro-5-methylphenyl)urea
CID 6468024

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-difluorophenyl)-3-(2-ethylphenyl)urea?
The IUPAC name of 1-(2,5-difluorophenyl)-3-(2-ethylphenyl)urea (CID 6465020) is 1-(2,5-difluorophenyl)-3-(2-ethylphenyl)urea.
What is the SMILES notation for 1-(2,5-difluorophenyl)-3-(2-ethylphenyl)urea?
The canonical SMILES for 1-(2,5-difluorophenyl)-3-(2-ethylphenyl)urea is CCc1ccccc1NC(=O)Nc1cc(F)ccc1F.
What is the InChIKey of 1-(2,5-difluorophenyl)-3-(2-ethylphenyl)urea?
The InChIKey is KILDDABAUQNOMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O/c1-2-10-5-3-4-6-13(10)18-15(20)19-14-9-11(16)7-8-12(14)17/h3-9H,2H2,1H3,(H2,18,19,20).
What are the key properties of 1-(2,5-difluorophenyl)-3-(2-ethylphenyl)urea?
1-(2,5-difluorophenyl)-3-(2-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-(2,5-difluorophenyl)-3-(2-ethylphenyl)urea is sourced from PubChem (CID 6465020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).