N'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide

C18H12F2N2O3 — CID 9084734

IUPACN'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide
SMILESO=C(NNC(=O)c1ccccc1F)c1ccc(-c2ccc(F)cc2)o1
InChIInChI=1S/C18H12F2N2O3/c19-12-7-5-11(6-8-12)15-9-10-16(25-15)18(24)22-21-17(23)13-3-1-2-4-14(13)20/h1-10H,(H,21,23)(H,22,24)
InChIKeyPDMKYGFLILHQBM-UHFFFAOYSA-N
MW342.30 g/mol
LogP3.30
Rot. Bonds3

About N'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide

N'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide (PubChem CID 9084734) has the molecular formula C18H12F2N2O3 and a molecular weight of 342.30 g/mol. Its IUPAC name is N'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide.

Molecular Properties

Compound NameN'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide
PubChem CID9084734
Molecular FormulaC18H12F2N2O3
Molecular Weight342.30 g/mol
Exact Mass342.08
IUPAC NameN'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide
SMILESO=C(NNC(=O)c1ccccc1F)c1ccc(-c2ccc(F)cc2)o1
InChIInChI=1S/C18H12F2N2O3/c19-12-7-5-11(6-8-12)15-9-10-16(25-15)18(24)22-21-17(23)13-3-1-2-4-14(13)20/h1-10H,(H,21,23)(H,22,24)
InChIKeyPDMKYGFLILHQBM-UHFFFAOYSA-N
XLogP3.30
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.30
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-(4-fluorophenyl)-N'-(3-hydroxynaphthalene-2-carbonyl)furan-2-carbohydrazide
CID 18272087
5-(4-fluorophenyl)-N'-[2-(4-fluorophenyl)acetyl]furan-2-carbohydrazide
CID 31725805
N'-(2-chlorobenzoyl)-5-(3-fluorophenyl)furan-2-carbohydrazide
CID 24900153
N-[2-(cyclopropylcarbamoyl)phenyl]-5-(4-fluorophenyl)furan-2-carboxamide
CID 29353067
5-(4-fluorophenyl)-N'-(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)furan-2-carbohydrazide
CID 18871656
N'-(2-fluorobenzoyl)-5-nitrofuran-2-carbohydrazide
CID 102603103
N-(2-chlorophenyl)-5-(4-fluorophenyl)furan-2-carboxamide
CID 3436050
5-(4-fluorophenyl)-N-propan-2-ylfuran-2-carboxamide
CID 4290851
N-(4-chlorophenyl)-5-(4-fluorophenyl)furan-2-carboxamide
CID 18871483
N'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide
CID 4795196
methyl 3-[[5-(4-fluorophenyl)furan-2-carbonyl]amino]propanoate
CID 37351586
N-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide
CID 51475340

Frequently Asked Questions

What is the IUPAC name of N'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide?
The IUPAC name of N'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide (CID 9084734) is N'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide.
What is the SMILES notation for N'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide?
The canonical SMILES for N'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide is O=C(NNC(=O)c1ccccc1F)c1ccc(-c2ccc(F)cc2)o1.
What is the InChIKey of N'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide?
The InChIKey is PDMKYGFLILHQBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12F2N2O3/c19-12-7-5-11(6-8-12)15-9-10-16(25-15)18(24)22-21-17(23)13-3-1-2-4-14(13)20/h1-10H,(H,21,23)(H,22,24).
What are the key properties of N'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide?
N'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide has a molecular weight of 342.30 g/mol, XLogP of 3.30, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide is sourced from PubChem (CID 9084734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).