N',N'-dibenzyl-2-fluorobenzohydrazide

C21H19FN2O — CID 9293723

IUPACN',N'-dibenzyl-2-fluorobenzohydrazide
SMILESO=C(NN(Cc1ccccc1)Cc1ccccc1)c1ccccc1F
InChIInChI=1S/C21H19FN2O/c22-20-14-8-7-13-19(20)21(25)23-24(15-17-9-3-1-4-10-17)16-18-11-5-2-6-12-18/h1-14H,15-16H2,(H,23,25)
InChIKeyXFIQBRGMJZROBE-UHFFFAOYSA-N
MW334.39 g/mol
LogP4.17
Rot. Bonds6

About N',N'-dibenzyl-2-fluorobenzohydrazide

N',N'-dibenzyl-2-fluorobenzohydrazide (PubChem CID 9293723) has the molecular formula C21H19FN2O and a molecular weight of 334.39 g/mol. Its IUPAC name is N',N'-dibenzyl-2-fluorobenzohydrazide.

Molecular Properties

Compound NameN',N'-dibenzyl-2-fluorobenzohydrazide
PubChem CID9293723
Molecular FormulaC21H19FN2O
Molecular Weight334.39 g/mol
Exact Mass334.15
IUPAC NameN',N'-dibenzyl-2-fluorobenzohydrazide
SMILESO=C(NN(Cc1ccccc1)Cc1ccccc1)c1ccccc1F
InChIInChI=1S/C21H19FN2O/c22-20-14-8-7-13-19(20)21(25)23-24(15-17-9-3-1-4-10-17)16-18-11-5-2-6-12-18/h1-14H,15-16H2,(H,23,25)
InChIKeyXFIQBRGMJZROBE-UHFFFAOYSA-N
XLogP4.17
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.39
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N',N'-dibenzyl-2-bromobenzohydrazide
CID 3531663
N-[3-[benzyl(methyl)amino]propyl]-2-fluorobenzamide
CID 110444087
N-[2-[benzyl(methylsulfonyl)amino]ethyl]-2-fluorobenzamide
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2-fluoro-N-(4-phenylbutyl)benzamide
CID 2057513
N-[2-[benzyl(propan-2-yl)amino]-2-oxoethyl]-2-fluorobenzamide
CID 112995050
N',N'-dibenzyl-2-oxochromene-3-carbohydrazide
CID 9293863
2-fluoro-N-[2-oxo-2-(3-phenylpropylamino)ethyl]benzamide
CID 2463726
2-fluoro-N-[2-oxo-2-[2-(2-phenylacetyl)hydrazinyl]ethyl]benzamide
CID 24637562
N-[6-(N-benzylanilino)-3-pyridinyl]-2-fluorobenzamide
CID 113021176
2-fluoro-N-(1-phenylbutan-2-yl)benzamide
CID 2973548
2-[benzyl(2-hydroxyethyl)amino]-1-(2-fluorophenyl)ethanone
CID 62114429
ethane;2-fluorobenzoic acid
CID 91182768

Frequently Asked Questions

What is the IUPAC name of N',N'-dibenzyl-2-fluorobenzohydrazide?
The IUPAC name of N',N'-dibenzyl-2-fluorobenzohydrazide (CID 9293723) is N',N'-dibenzyl-2-fluorobenzohydrazide.
What is the SMILES notation for N',N'-dibenzyl-2-fluorobenzohydrazide?
The canonical SMILES for N',N'-dibenzyl-2-fluorobenzohydrazide is O=C(NN(Cc1ccccc1)Cc1ccccc1)c1ccccc1F.
What is the InChIKey of N',N'-dibenzyl-2-fluorobenzohydrazide?
The InChIKey is XFIQBRGMJZROBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19FN2O/c22-20-14-8-7-13-19(20)21(25)23-24(15-17-9-3-1-4-10-17)16-18-11-5-2-6-12-18/h1-14H,15-16H2,(H,23,25).
What are the key properties of N',N'-dibenzyl-2-fluorobenzohydrazide?
N',N'-dibenzyl-2-fluorobenzohydrazide has a molecular weight of 334.39 g/mol, XLogP of 4.17, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dibenzyl-2-fluorobenzohydrazide is sourced from PubChem (CID 9293723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).