2-(2-chlorophenyl)-N'-(2-fluorophenyl)-N-hydrazinylbenzenecarboximidamide

C19H16ClFN4 — CID 135227701

IUPAC2-(2-chlorophenyl)-N'-(2-fluorophenyl)-N-hydrazinylbenzenecarboximidamide
SMILESNNN/C(=N\c1ccccc1F)c1ccccc1-c1ccccc1Cl
InChIInChI=1S/C19H16ClFN4/c20-16-10-4-3-8-14(16)13-7-1-2-9-15(13)19(24-25-22)23-18-12-6-5-11-17(18)21/h1-12,25H,22H2,(H,23,24)
InChIKeyZPJYGIDDUKWMPA-UHFFFAOYSA-N
MW354.82 g/mol
LogP4.19
Rot. Bonds4

About 2-(2-chlorophenyl)-N'-(2-fluorophenyl)-N-hydrazinylbenzenecarboximidamide

2-(2-chlorophenyl)-N'-(2-fluorophenyl)-N-hydrazinylbenzenecarboximidamide (PubChem CID 135227701) has the molecular formula C19H16ClFN4 and a molecular weight of 354.82 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N'-(2-fluorophenyl)-N-hydrazinylbenzenecarboximidamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N'-(2-fluorophenyl)-N-hydrazinylbenzenecarboximidamide
PubChem CID135227701
Molecular FormulaC19H16ClFN4
Molecular Weight354.82 g/mol
Exact Mass354.10
IUPAC Name2-(2-chlorophenyl)-N'-(2-fluorophenyl)-N-hydrazinylbenzenecarboximidamide
SMILESNNN/C(=N\c1ccccc1F)c1ccccc1-c1ccccc1Cl
InChIInChI=1S/C19H16ClFN4/c20-16-10-4-3-8-14(16)13-7-1-2-9-15(13)19(24-25-22)23-18-12-6-5-11-17(18)21/h1-12,25H,22H2,(H,23,24)
InChIKeyZPJYGIDDUKWMPA-UHFFFAOYSA-N
XLogP4.19
TPSA62.44 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.82
LogP ≤ 54.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N'-(2-fluorophenyl)-N-hydrazinylbenzenecarboximidamide?
The IUPAC name of 2-(2-chlorophenyl)-N'-(2-fluorophenyl)-N-hydrazinylbenzenecarboximidamide (CID 135227701) is 2-(2-chlorophenyl)-N'-(2-fluorophenyl)-N-hydrazinylbenzenecarboximidamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N'-(2-fluorophenyl)-N-hydrazinylbenzenecarboximidamide?
The canonical SMILES for 2-(2-chlorophenyl)-N'-(2-fluorophenyl)-N-hydrazinylbenzenecarboximidamide is NNN/C(=N\c1ccccc1F)c1ccccc1-c1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenyl)-N'-(2-fluorophenyl)-N-hydrazinylbenzenecarboximidamide?
The InChIKey is ZPJYGIDDUKWMPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClFN4/c20-16-10-4-3-8-14(16)13-7-1-2-9-15(13)19(24-25-22)23-18-12-6-5-11-17(18)21/h1-12,25H,22H2,(H,23,24).
What are the key properties of 2-(2-chlorophenyl)-N'-(2-fluorophenyl)-N-hydrazinylbenzenecarboximidamide?
2-(2-chlorophenyl)-N'-(2-fluorophenyl)-N-hydrazinylbenzenecarboximidamide has a molecular weight of 354.82 g/mol, XLogP of 4.19, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N'-(2-fluorophenyl)-N-hydrazinylbenzenecarboximidamide is sourced from PubChem (CID 135227701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).