2-fluoro-5-nitro-N',N'-diphenylbenzohydrazide

C19H14FN3O3 — CID 14956442

IUPAC2-fluoro-5-nitro-N',N'-diphenylbenzohydrazide
SMILESO=C(NN(c1ccccc1)c1ccccc1)c1cc([N+](=O)[O-])ccc1F
InChIInChI=1S/C19H14FN3O3/c20-18-12-11-16(23(25)26)13-17(18)19(24)21-22(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13H,(H,21,24)
InChIKeyNRYBBXMPBSGBHR-UHFFFAOYSA-N
MW351.34 g/mol
LogP4.22
Rot. Bonds5

About 2-fluoro-5-nitro-N',N'-diphenylbenzohydrazide

2-fluoro-5-nitro-N',N'-diphenylbenzohydrazide (PubChem CID 14956442) has the molecular formula C19H14FN3O3 and a molecular weight of 351.34 g/mol. Its IUPAC name is 2-fluoro-5-nitro-N',N'-diphenylbenzohydrazide.

Molecular Properties

Compound Name2-fluoro-5-nitro-N',N'-diphenylbenzohydrazide
PubChem CID14956442
Molecular FormulaC19H14FN3O3
Molecular Weight351.34 g/mol
Exact Mass351.10
IUPAC Name2-fluoro-5-nitro-N',N'-diphenylbenzohydrazide
SMILESO=C(NN(c1ccccc1)c1ccccc1)c1cc([N+](=O)[O-])ccc1F
InChIInChI=1S/C19H14FN3O3/c20-18-12-11-16(23(25)26)13-17(18)19(24)21-22(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13H,(H,21,24)
InChIKeyNRYBBXMPBSGBHR-UHFFFAOYSA-N
XLogP4.22
TPSA75.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.34
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-fluoro-5-nitro-N',N'-diphenylbenzohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-nitro-N',N'-diphenylbenzohydrazide?
The IUPAC name of 2-fluoro-5-nitro-N',N'-diphenylbenzohydrazide (CID 14956442) is 2-fluoro-5-nitro-N',N'-diphenylbenzohydrazide.
What is the SMILES notation for 2-fluoro-5-nitro-N',N'-diphenylbenzohydrazide?
The canonical SMILES for 2-fluoro-5-nitro-N',N'-diphenylbenzohydrazide is O=C(NN(c1ccccc1)c1ccccc1)c1cc([N+](=O)[O-])ccc1F.
What is the InChIKey of 2-fluoro-5-nitro-N',N'-diphenylbenzohydrazide?
The InChIKey is NRYBBXMPBSGBHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FN3O3/c20-18-12-11-16(23(25)26)13-17(18)19(24)21-22(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13H,(H,21,24).
What are the key properties of 2-fluoro-5-nitro-N',N'-diphenylbenzohydrazide?
2-fluoro-5-nitro-N',N'-diphenylbenzohydrazide has a molecular weight of 351.34 g/mol, XLogP of 4.22, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-nitro-N',N'-diphenylbenzohydrazide is sourced from PubChem (CID 14956442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).