N'-(3,5-difluorobenzoyl)furan-2-carbohydrazide

C12H8F2N2O3 — CID 6711004

IUPACN'-(3,5-difluorobenzoyl)furan-2-carbohydrazide
SMILESO=C(NNC(=O)c1ccco1)c1cc(F)cc(F)c1
InChIInChI=1S/C12H8F2N2O3/c13-8-4-7(5-9(14)6-8)11(17)15-16-12(18)10-2-1-3-19-10/h1-6H,(H,15,17)(H,16,18)
InChIKeyFRNPWBREDAJXMB-UHFFFAOYSA-N
MW266.20 g/mol
LogP1.63
Rot. Bonds2

About N'-(3,5-difluorobenzoyl)furan-2-carbohydrazide

N'-(3,5-difluorobenzoyl)furan-2-carbohydrazide (PubChem CID 6711004) has the molecular formula C12H8F2N2O3 and a molecular weight of 266.20 g/mol. Its IUPAC name is N'-(3,5-difluorobenzoyl)furan-2-carbohydrazide.

Molecular Properties

Compound NameN'-(3,5-difluorobenzoyl)furan-2-carbohydrazide
PubChem CID6711004
Molecular FormulaC12H8F2N2O3
Molecular Weight266.20 g/mol
Exact Mass266.05
IUPAC NameN'-(3,5-difluorobenzoyl)furan-2-carbohydrazide
SMILESO=C(NNC(=O)c1ccco1)c1cc(F)cc(F)c1
InChIInChI=1S/C12H8F2N2O3/c13-8-4-7(5-9(14)6-8)11(17)15-16-12(18)10-2-1-3-19-10/h1-6H,(H,15,17)(H,16,18)
InChIKeyFRNPWBREDAJXMB-UHFFFAOYSA-N
XLogP1.63
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.20
LogP ≤ 51.63
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

N'-[4-(trifluoromethyl)benzoyl]furan-2-carbohydrazide
CID 4826998
N'-(4-bromobenzoyl)furan-2-carbohydrazide
CID 687073
[2-[2-(furan-2-carbonyl)hydrazinyl]-2-oxoethyl] 3-fluorobenzoate
CID 8612232
N'-(4-fluoro-3-nitrobenzoyl)furan-2-carbohydrazide
CID 135347144
N-[4-[(furan-2-carbonylamino)carbamoyl]phenyl]acetamide
CID 6736260
N'-(furan-2-carbonyl)-2,3-dihydro-1,4-benzodioxine-6-carbohydrazide
CID 9477205
N'-(3-cyanobenzoyl)furan-2-carbohydrazide
CID 9477248
methyl N-(furan-2-carbonylamino)carbamate
CID 909545
N-[4-[(3,5-difluorophenyl)carbamothioylamino]phenyl]furan-2-carboxamide
CID 53488888
N'-(3-nitrobenzoyl)furan-2-carbohydrazide
CID 3127339
N-(4-fluorophenyl)furan-2-carboxamide
CID 531893
N-(3-amino-5-fluorophenyl)furan-2-carboxamide
CID 107333848

Frequently Asked Questions

What is the IUPAC name of N'-(3,5-difluorobenzoyl)furan-2-carbohydrazide?
The IUPAC name of N'-(3,5-difluorobenzoyl)furan-2-carbohydrazide (CID 6711004) is N'-(3,5-difluorobenzoyl)furan-2-carbohydrazide.
What is the SMILES notation for N'-(3,5-difluorobenzoyl)furan-2-carbohydrazide?
The canonical SMILES for N'-(3,5-difluorobenzoyl)furan-2-carbohydrazide is O=C(NNC(=O)c1ccco1)c1cc(F)cc(F)c1.
What is the InChIKey of N'-(3,5-difluorobenzoyl)furan-2-carbohydrazide?
The InChIKey is FRNPWBREDAJXMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8F2N2O3/c13-8-4-7(5-9(14)6-8)11(17)15-16-12(18)10-2-1-3-19-10/h1-6H,(H,15,17)(H,16,18).
What are the key properties of N'-(3,5-difluorobenzoyl)furan-2-carbohydrazide?
N'-(3,5-difluorobenzoyl)furan-2-carbohydrazide has a molecular weight of 266.20 g/mol, XLogP of 1.63, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3,5-difluorobenzoyl)furan-2-carbohydrazide is sourced from PubChem (CID 6711004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).