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

C7H11FN2 — CID 139397668

IUPAC1-(4-fluorocyclohexa-1,3-dien-1-yl)-1-methylhydrazine
SMILESCN(N)C1=CC=C(F)CC1
InChIInChI=1S/C7H11FN2/c1-10(9)7-4-2-6(8)3-5-7/h2,4H,3,5,9H2,1H3
InChIKeyZCHLLONHUVKVQF-UHFFFAOYSA-N
MW142.18 g/mol
LogP1.32
Rot. Bonds1

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

1-(4-fluorocyclohexa-1,3-dien-1-yl)-1-methylhydrazine (PubChem CID 139397668) has the molecular formula C7H11FN2 and a molecular weight of 142.18 g/mol. Its IUPAC name is 1-(4-fluorocyclohexa-1,3-dien-1-yl)-1-methylhydrazine.

Molecular Properties

Compound Name1-(4-fluorocyclohexa-1,3-dien-1-yl)-1-methylhydrazine
PubChem CID139397668
Molecular FormulaC7H11FN2
Molecular Weight142.18 g/mol
Exact Mass142.09
IUPAC Name1-(4-fluorocyclohexa-1,3-dien-1-yl)-1-methylhydrazine
SMILESCN(N)C1=CC=C(F)CC1
InChIInChI=1S/C7H11FN2/c1-10(9)7-4-2-6(8)3-5-7/h2,4H,3,5,9H2,1H3
InChIKeyZCHLLONHUVKVQF-UHFFFAOYSA-N
XLogP1.32
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.18
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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 1-(4-fluorocyclohexa-1,3-dien-1-yl)-1-methylhydrazine?
The IUPAC name of 1-(4-fluorocyclohexa-1,3-dien-1-yl)-1-methylhydrazine (CID 139397668) is 1-(4-fluorocyclohexa-1,3-dien-1-yl)-1-methylhydrazine.
What is the SMILES notation for 1-(4-fluorocyclohexa-1,3-dien-1-yl)-1-methylhydrazine?
The canonical SMILES for 1-(4-fluorocyclohexa-1,3-dien-1-yl)-1-methylhydrazine is CN(N)C1=CC=C(F)CC1.
What is the InChIKey of 1-(4-fluorocyclohexa-1,3-dien-1-yl)-1-methylhydrazine?
The InChIKey is ZCHLLONHUVKVQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11FN2/c1-10(9)7-4-2-6(8)3-5-7/h2,4H,3,5,9H2,1H3.
What are the key properties of 1-(4-fluorocyclohexa-1,3-dien-1-yl)-1-methylhydrazine?
1-(4-fluorocyclohexa-1,3-dien-1-yl)-1-methylhydrazine has a molecular weight of 142.18 g/mol, XLogP of 1.32, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorocyclohexa-1,3-dien-1-yl)-1-methylhydrazine is sourced from PubChem (CID 139397668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).