3,5-difluoro-4-hydrazinyl-N-pyridin-3-ylbenzamide

C12H10F2N4O — CID 55158095

IUPAC3,5-difluoro-4-hydrazinyl-N-pyridin-3-ylbenzamide
SMILESNNc1c(F)cc(C(=O)Nc2cccnc2)cc1F
InChIInChI=1S/C12H10F2N4O/c13-9-4-7(5-10(14)11(9)18-15)12(19)17-8-2-1-3-16-6-8/h1-6,18H,15H2,(H,17,19)
InChIKeyMTPYJRLTPWNQLX-UHFFFAOYSA-N
MW264.24 g/mol
LogP1.90
Rot. Bonds3

About 3,5-difluoro-4-hydrazinyl-N-pyridin-3-ylbenzamide

3,5-difluoro-4-hydrazinyl-N-pyridin-3-ylbenzamide (PubChem CID 55158095) has the molecular formula C12H10F2N4O and a molecular weight of 264.24 g/mol. Its IUPAC name is 3,5-difluoro-4-hydrazinyl-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name3,5-difluoro-4-hydrazinyl-N-pyridin-3-ylbenzamide
PubChem CID55158095
Molecular FormulaC12H10F2N4O
Molecular Weight264.24 g/mol
Exact Mass264.08
IUPAC Name3,5-difluoro-4-hydrazinyl-N-pyridin-3-ylbenzamide
SMILESNNc1c(F)cc(C(=O)Nc2cccnc2)cc1F
InChIInChI=1S/C12H10F2N4O/c13-9-4-7(5-10(14)11(9)18-15)12(19)17-8-2-1-3-16-6-8/h1-6,18H,15H2,(H,17,19)
InChIKeyMTPYJRLTPWNQLX-UHFFFAOYSA-N
XLogP1.90
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.24
LogP ≤ 51.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-(ethylamino)-3,5-difluoro-N-pyridin-3-ylbenzamide
CID 63187094
3-fluoro-2-hydrazinyl-N-pyridin-3-ylbenzamide
CID 62660800
3,5-difluoro-N-(3-fluorophenyl)-4-hydrazinylbenzamide
CID 63186687
1-N,3-N-dipyridin-3-ylbenzene-1,3-dicarboxamide
CID 679756
3,5-dichloro-N-pyridin-3-ylbenzamide
CID 1245821
3-fluoro-4-methoxy-N-pyridin-3-ylbenzamide
CID 25343484
3,5-difluoro-4-hydrazinyl-N-(1,2-oxazol-4-yl)benzamide
CID 63186618
4-hydrazinyl-3-methyl-N-pyridin-3-ylbenzamide
CID 63212144
N-pyridin-3-ylbenzamide;dihydrochloride
CID 174671785
2-ethyl-6-hydrazinyl-N-pyridin-3-ylpyridine-4-carboxamide
CID 113381139
4-hydroxy-N-pyridin-3-ylbenzamide
CID 15965764
4-fluoro-3-nitro-N-pyridin-3-ylbenzamide
CID 43215734

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-4-hydrazinyl-N-pyridin-3-ylbenzamide?
The IUPAC name of 3,5-difluoro-4-hydrazinyl-N-pyridin-3-ylbenzamide (CID 55158095) is 3,5-difluoro-4-hydrazinyl-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 3,5-difluoro-4-hydrazinyl-N-pyridin-3-ylbenzamide?
The canonical SMILES for 3,5-difluoro-4-hydrazinyl-N-pyridin-3-ylbenzamide is NNc1c(F)cc(C(=O)Nc2cccnc2)cc1F.
What is the InChIKey of 3,5-difluoro-4-hydrazinyl-N-pyridin-3-ylbenzamide?
The InChIKey is MTPYJRLTPWNQLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10F2N4O/c13-9-4-7(5-10(14)11(9)18-15)12(19)17-8-2-1-3-16-6-8/h1-6,18H,15H2,(H,17,19).
What are the key properties of 3,5-difluoro-4-hydrazinyl-N-pyridin-3-ylbenzamide?
3,5-difluoro-4-hydrazinyl-N-pyridin-3-ylbenzamide has a molecular weight of 264.24 g/mol, XLogP of 1.90, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-4-hydrazinyl-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 55158095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).