N'-(2-fluorobenzoyl)-3-methylfuran-2-carbohydrazide

C13H11FN2O3 — CID 34264289

IUPACN'-(2-fluorobenzoyl)-3-methylfuran-2-carbohydrazide
SMILESCc1ccoc1C(=O)NNC(=O)c1ccccc1F
InChIInChI=1S/C13H11FN2O3/c1-8-6-7-19-11(8)13(18)16-15-12(17)9-4-2-3-5-10(9)14/h2-7H,1H3,(H,15,17)(H,16,18)
InChIKeyRQRSLBMGLOELBW-UHFFFAOYSA-N
MW262.24 g/mol
LogP1.80
Rot. Bonds2

About N'-(2-fluorobenzoyl)-3-methylfuran-2-carbohydrazide

N'-(2-fluorobenzoyl)-3-methylfuran-2-carbohydrazide (PubChem CID 34264289) has the molecular formula C13H11FN2O3 and a molecular weight of 262.24 g/mol. Its IUPAC name is N'-(2-fluorobenzoyl)-3-methylfuran-2-carbohydrazide.

Molecular Properties

Compound NameN'-(2-fluorobenzoyl)-3-methylfuran-2-carbohydrazide
PubChem CID34264289
Molecular FormulaC13H11FN2O3
Molecular Weight262.24 g/mol
Exact Mass262.08
IUPAC NameN'-(2-fluorobenzoyl)-3-methylfuran-2-carbohydrazide
SMILESCc1ccoc1C(=O)NNC(=O)c1ccccc1F
InChIInChI=1S/C13H11FN2O3/c1-8-6-7-19-11(8)13(18)16-15-12(17)9-4-2-3-5-10(9)14/h2-7H,1H3,(H,15,17)(H,16,18)
InChIKeyRQRSLBMGLOELBW-UHFFFAOYSA-N
XLogP1.80
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.24
LogP ≤ 51.80
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

2-fluoro-N-[2-[2-(2-methylbenzoyl)hydrazinyl]-2-oxoethyl]benzamide
CID 9220655
N'-[(2S)-2-chloropropanoyl]-2-fluorobenzohydrazide
CID 97300264
N-(4-fluoro-1H-indazol-3-yl)-3-methylfuran-2-carboxamide
CID 51102710
N-(2,6-dimethylphenyl)-2-fluorobenzamide
CID 4097270
2-fluoro-N-(2-fluoro-6-methylphenyl)benzamide
CID 115909344
ethane;2-fluoro-N-methylbenzamide
CID 178102327
2-fluoro-N-methylbenzamide;hydrate
CID 141303255
N'-(2-fluorobenzoyl)pyridine-4-carbohydrazide
CID 959956
N'-[2-(5-chloro-6-methyl-1-benzofuran-3-yl)acetyl]-2-fluorobenzohydrazide
CID 18872065
2-fluoro-N'-[4-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]benzoyl]benzohydrazide
CID 134031148
N'-[2-(5-chloro-4,6-dimethyl-1-benzofuran-3-yl)acetyl]-2-fluorobenzohydrazide
CID 18872224
N-(2,5-dimethylpyrrol-1-yl)-2-fluorobenzamide
CID 43822402

Frequently Asked Questions

What is the IUPAC name of N'-(2-fluorobenzoyl)-3-methylfuran-2-carbohydrazide?
The IUPAC name of N'-(2-fluorobenzoyl)-3-methylfuran-2-carbohydrazide (CID 34264289) is N'-(2-fluorobenzoyl)-3-methylfuran-2-carbohydrazide.
What is the SMILES notation for N'-(2-fluorobenzoyl)-3-methylfuran-2-carbohydrazide?
The canonical SMILES for N'-(2-fluorobenzoyl)-3-methylfuran-2-carbohydrazide is Cc1ccoc1C(=O)NNC(=O)c1ccccc1F.
What is the InChIKey of N'-(2-fluorobenzoyl)-3-methylfuran-2-carbohydrazide?
The InChIKey is RQRSLBMGLOELBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN2O3/c1-8-6-7-19-11(8)13(18)16-15-12(17)9-4-2-3-5-10(9)14/h2-7H,1H3,(H,15,17)(H,16,18).
What are the key properties of N'-(2-fluorobenzoyl)-3-methylfuran-2-carbohydrazide?
N'-(2-fluorobenzoyl)-3-methylfuran-2-carbohydrazide has a molecular weight of 262.24 g/mol, XLogP of 1.80, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-fluorobenzoyl)-3-methylfuran-2-carbohydrazide is sourced from PubChem (CID 34264289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).