(4-fluorocyclohexa-1,3-dien-1-yl)hydrazine

C6H9FN2 — CID 90361119

IUPAC(4-fluorocyclohexa-1,3-dien-1-yl)hydrazine
SMILESNNC1=CC=C(F)CC1
InChIInChI=1S/C6H9FN2/c7-5-1-3-6(9-8)4-2-5/h1,3,9H,2,4,8H2
InChIKeyDZJRVZSRTFBRMR-UHFFFAOYSA-N
MW128.15 g/mol
LogP0.98
Rot. Bonds1

About (4-fluorocyclohexa-1,3-dien-1-yl)hydrazine

(4-fluorocyclohexa-1,3-dien-1-yl)hydrazine (PubChem CID 90361119) has the molecular formula C6H9FN2 and a molecular weight of 128.15 g/mol. Its IUPAC name is (4-fluorocyclohexa-1,3-dien-1-yl)hydrazine.

Molecular Properties

Compound Name(4-fluorocyclohexa-1,3-dien-1-yl)hydrazine
PubChem CID90361119
Molecular FormulaC6H9FN2
Molecular Weight128.15 g/mol
Exact Mass128.07
IUPAC Name(4-fluorocyclohexa-1,3-dien-1-yl)hydrazine
SMILESNNC1=CC=C(F)CC1
InChIInChI=1S/C6H9FN2/c7-5-1-3-6(9-8)4-2-5/h1,3,9H,2,4,8H2
InChIKeyDZJRVZSRTFBRMR-UHFFFAOYSA-N
XLogP0.98
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.15
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (4-fluorocyclohexa-1,3-dien-1-yl)hydrazine 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 (4-fluorocyclohexa-1,3-dien-1-yl)hydrazine?
The IUPAC name of (4-fluorocyclohexa-1,3-dien-1-yl)hydrazine (CID 90361119) is (4-fluorocyclohexa-1,3-dien-1-yl)hydrazine.
What is the SMILES notation for (4-fluorocyclohexa-1,3-dien-1-yl)hydrazine?
The canonical SMILES for (4-fluorocyclohexa-1,3-dien-1-yl)hydrazine is NNC1=CC=C(F)CC1.
What is the InChIKey of (4-fluorocyclohexa-1,3-dien-1-yl)hydrazine?
The InChIKey is DZJRVZSRTFBRMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9FN2/c7-5-1-3-6(9-8)4-2-5/h1,3,9H,2,4,8H2.
What are the key properties of (4-fluorocyclohexa-1,3-dien-1-yl)hydrazine?
(4-fluorocyclohexa-1,3-dien-1-yl)hydrazine has a molecular weight of 128.15 g/mol, XLogP of 0.98, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorocyclohexa-1,3-dien-1-yl)hydrazine is sourced from PubChem (CID 90361119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).