N'-(2-chlorobenzoyl)-5-(3-fluorophenyl)furan-2-carbohydrazide

C18H12ClFN2O3 — CID 24900153

IUPACN'-(2-chlorobenzoyl)-5-(3-fluorophenyl)furan-2-carbohydrazide
SMILESO=C(NNC(=O)c1ccccc1Cl)c1ccc(-c2cccc(F)c2)o1
InChIInChI=1S/C18H12ClFN2O3/c19-14-7-2-1-6-13(14)17(23)21-22-18(24)16-9-8-15(25-16)11-4-3-5-12(20)10-11/h1-10H,(H,21,23)(H,22,24)
InChIKeyYWMTWGNIIANYDJ-UHFFFAOYSA-N
MW358.76 g/mol
LogP3.81
Rot. Bonds3

About N'-(2-chlorobenzoyl)-5-(3-fluorophenyl)furan-2-carbohydrazide

N'-(2-chlorobenzoyl)-5-(3-fluorophenyl)furan-2-carbohydrazide (PubChem CID 24900153) has the molecular formula C18H12ClFN2O3 and a molecular weight of 358.76 g/mol. Its IUPAC name is N'-(2-chlorobenzoyl)-5-(3-fluorophenyl)furan-2-carbohydrazide.

Molecular Properties

Compound NameN'-(2-chlorobenzoyl)-5-(3-fluorophenyl)furan-2-carbohydrazide
PubChem CID24900153
Molecular FormulaC18H12ClFN2O3
Molecular Weight358.76 g/mol
Exact Mass358.05
IUPAC NameN'-(2-chlorobenzoyl)-5-(3-fluorophenyl)furan-2-carbohydrazide
SMILESO=C(NNC(=O)c1ccccc1Cl)c1ccc(-c2cccc(F)c2)o1
InChIInChI=1S/C18H12ClFN2O3/c19-14-7-2-1-6-13(14)17(23)21-22-18(24)16-9-8-15(25-16)11-4-3-5-12(20)10-11/h1-10H,(H,21,23)(H,22,24)
InChIKeyYWMTWGNIIANYDJ-UHFFFAOYSA-N
XLogP3.81
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.76
LogP ≤ 53.81
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-(3-fluorophenyl)-N'-(4-methoxybenzoyl)furan-2-carbohydrazide
CID 24900154
N'-(2-fluorobenzoyl)-5-(4-fluorophenyl)furan-2-carbohydrazide
CID 9084734
5-(2-chlorophenyl)-N-(3-fluorophenyl)furan-2-carboxamide
CID 9072315
5-(4-fluorophenyl)-N'-(3-hydroxynaphthalene-2-carbonyl)furan-2-carbohydrazide
CID 18272087
N-(2-chlorophenyl)-5-(4-fluorophenyl)furan-2-carboxamide
CID 3436050
N-[2-[2-(2-chlorobenzoyl)hydrazinyl]-2-oxoethyl]-3-fluorobenzamide
CID 35929184
2,6-dichloro-N'-(2-chlorobenzoyl)benzohydrazide
CID 78774908
5-(4-fluorophenyl)-N'-[2-(4-fluorophenyl)acetyl]furan-2-carbohydrazide
CID 31725805
1-phenyl-3-[[5-[3-(trifluoromethyl)phenyl]furan-2-carbonyl]amino]thiourea
CID 18871683
N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-5-(3-chlorophenyl)furan-2-carboxamide
CID 17317117
5-(2-chlorophenyl)-N-(5-fluoro-2-methylphenyl)furan-2-carboxamide
CID 9077694
N'-(3,3-dimethylbutanoyl)-5-[3-(trifluoromethyl)phenyl]furan-2-carbohydrazide
CID 86888462

Frequently Asked Questions

What is the IUPAC name of N'-(2-chlorobenzoyl)-5-(3-fluorophenyl)furan-2-carbohydrazide?
The IUPAC name of N'-(2-chlorobenzoyl)-5-(3-fluorophenyl)furan-2-carbohydrazide (CID 24900153) is N'-(2-chlorobenzoyl)-5-(3-fluorophenyl)furan-2-carbohydrazide.
What is the SMILES notation for N'-(2-chlorobenzoyl)-5-(3-fluorophenyl)furan-2-carbohydrazide?
The canonical SMILES for N'-(2-chlorobenzoyl)-5-(3-fluorophenyl)furan-2-carbohydrazide is O=C(NNC(=O)c1ccccc1Cl)c1ccc(-c2cccc(F)c2)o1.
What is the InChIKey of N'-(2-chlorobenzoyl)-5-(3-fluorophenyl)furan-2-carbohydrazide?
The InChIKey is YWMTWGNIIANYDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12ClFN2O3/c19-14-7-2-1-6-13(14)17(23)21-22-18(24)16-9-8-15(25-16)11-4-3-5-12(20)10-11/h1-10H,(H,21,23)(H,22,24).
What are the key properties of N'-(2-chlorobenzoyl)-5-(3-fluorophenyl)furan-2-carbohydrazide?
N'-(2-chlorobenzoyl)-5-(3-fluorophenyl)furan-2-carbohydrazide has a molecular weight of 358.76 g/mol, XLogP of 3.81, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-chlorobenzoyl)-5-(3-fluorophenyl)furan-2-carbohydrazide is sourced from PubChem (CID 24900153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).