1-(3,5-difluorophenyl)-3-pyridazin-4-ylurea

C11H8F2N4O — CID 14100224

IUPAC1-(3,5-difluorophenyl)-3-pyridazin-4-ylurea
SMILESO=C(Nc1ccnnc1)Nc1cc(F)cc(F)c1
InChIInChI=1S/C11H8F2N4O/c12-7-3-8(13)5-10(4-7)17-11(18)16-9-1-2-14-15-6-9/h1-6H,(H2,14,16,17,18)
InChIKeyQIGXWFFHISNIJH-UHFFFAOYSA-N
MW250.21 g/mol
LogP2.40
Rot. Bonds2

About 1-(3,5-difluorophenyl)-3-pyridazin-4-ylurea

1-(3,5-difluorophenyl)-3-pyridazin-4-ylurea (PubChem CID 14100224) has the molecular formula C11H8F2N4O and a molecular weight of 250.21 g/mol. Its IUPAC name is 1-(3,5-difluorophenyl)-3-pyridazin-4-ylurea.

Molecular Properties

Compound Name1-(3,5-difluorophenyl)-3-pyridazin-4-ylurea
PubChem CID14100224
Molecular FormulaC11H8F2N4O
Molecular Weight250.21 g/mol
Exact Mass250.07
IUPAC Name1-(3,5-difluorophenyl)-3-pyridazin-4-ylurea
SMILESO=C(Nc1ccnnc1)Nc1cc(F)cc(F)c1
InChIInChI=1S/C11H8F2N4O/c12-7-3-8(13)5-10(4-7)17-11(18)16-9-1-2-14-15-6-9/h1-6H,(H2,14,16,17,18)
InChIKeyQIGXWFFHISNIJH-UHFFFAOYSA-N
XLogP2.40
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.21
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(3,5-difluorophenyl)-3-pyridazin-4-ylurea 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-(4-Fluorophenyl)-3-(1-phenyl-5-propylpyrazol-4-yl)urea
CID 2807997
1-(2-Fluorophenyl)-3-(2-((5-(pyrrolidin-1-yl)pyridazin-3-yl)amino)ethyl)urea
CID 71807479
1-(1,3-Dimethylpyrazol-4-yl)-3-(4-fluorophenyl)urea
CID 2811435
1-(4-Fluorophenyl)-3-(1-pyrazol-1-ylpropan-2-yl)urea
CID 45814217
1-(3,4-Difluorophenyl)-3-(1,3,5-trimethylpyrazol-4-yl)urea
CID 47032156
N-[1-(2-amino-2-oxoethyl)pyrazol-4-yl]-4-(4-fluorophenyl)piperazine-1-carboxamide
CID 53502526
1-(2-fluorophenyl)-3-(5-methyl-1H-pyrazol-4-yl)urea
CID 47083640
1-(1-Tert-butylpyrazol-4-yl)-3-(3-fluorophenyl)urea
CID 47467066
N-(3-fluorophenyl)-2-[2-(1H-pyrazol-1-yl)ethyl]-1-piperidinecarboxamide
CID 56887203
4-(2-(1H-pyrazol-1-yl)ethyl)-N-(4-fluorophenyl)piperazine-1-carboxamide
CID 71783838
1-(2,6-difluorophenyl)-3-(1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazol-4-yl)urea
CID 71810265
1-[2-(Dimethylamino)ethyl]-3-[1-(2-fluorophenyl)pyrazol-4-yl]-1-methylurea
CID 71856033

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-difluorophenyl)-3-pyridazin-4-ylurea?
The IUPAC name of 1-(3,5-difluorophenyl)-3-pyridazin-4-ylurea (CID 14100224) is 1-(3,5-difluorophenyl)-3-pyridazin-4-ylurea.
What is the SMILES notation for 1-(3,5-difluorophenyl)-3-pyridazin-4-ylurea?
The canonical SMILES for 1-(3,5-difluorophenyl)-3-pyridazin-4-ylurea is O=C(Nc1ccnnc1)Nc1cc(F)cc(F)c1.
What is the InChIKey of 1-(3,5-difluorophenyl)-3-pyridazin-4-ylurea?
The InChIKey is QIGXWFFHISNIJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F2N4O/c12-7-3-8(13)5-10(4-7)17-11(18)16-9-1-2-14-15-6-9/h1-6H,(H2,14,16,17,18).
What are the key properties of 1-(3,5-difluorophenyl)-3-pyridazin-4-ylurea?
1-(3,5-difluorophenyl)-3-pyridazin-4-ylurea has a molecular weight of 250.21 g/mol, XLogP of 2.40, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-difluorophenyl)-3-pyridazin-4-ylurea is sourced from PubChem (CID 14100224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).