1-(2-fluorophenyl)dodecylhydrazine

C18H31FN2 — CID 105292285

IUPAC1-(2-fluorophenyl)dodecylhydrazine
SMILESCCCCCCCCCCCC(NN)c1ccccc1F
InChIInChI=1S/C18H31FN2/c1-2-3-4-5-6-7-8-9-10-15-18(21-20)16-13-11-12-14-17(16)19/h11-14,18,21H,2-10,15,20H2,1H3
InChIKeyBNTLXWHPLWFUDJ-UHFFFAOYSA-N
MW294.46 g/mol
LogP5.25
Rot. Bonds12

About 1-(2-fluorophenyl)dodecylhydrazine

1-(2-fluorophenyl)dodecylhydrazine (PubChem CID 105292285) has the molecular formula C18H31FN2 and a molecular weight of 294.46 g/mol. Its IUPAC name is 1-(2-fluorophenyl)dodecylhydrazine.

Molecular Properties

Compound Name1-(2-fluorophenyl)dodecylhydrazine
PubChem CID105292285
Molecular FormulaC18H31FN2
Molecular Weight294.46 g/mol
Exact Mass294.25
IUPAC Name1-(2-fluorophenyl)dodecylhydrazine
SMILESCCCCCCCCCCCC(NN)c1ccccc1F
InChIInChI=1S/C18H31FN2/c1-2-3-4-5-6-7-8-9-10-15-18(21-20)16-13-11-12-14-17(16)19/h11-14,18,21H,2-10,15,20H2,1H3
InChIKeyBNTLXWHPLWFUDJ-UHFFFAOYSA-N
XLogP5.25
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.46
LogP ≤ 55.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-(2-fluorophenyl)dodecylhydrazine?
The IUPAC name of 1-(2-fluorophenyl)dodecylhydrazine (CID 105292285) is 1-(2-fluorophenyl)dodecylhydrazine.
What is the SMILES notation for 1-(2-fluorophenyl)dodecylhydrazine?
The canonical SMILES for 1-(2-fluorophenyl)dodecylhydrazine is CCCCCCCCCCCC(NN)c1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)dodecylhydrazine?
The InChIKey is BNTLXWHPLWFUDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31FN2/c1-2-3-4-5-6-7-8-9-10-15-18(21-20)16-13-11-12-14-17(16)19/h11-14,18,21H,2-10,15,20H2,1H3.
What are the key properties of 1-(2-fluorophenyl)dodecylhydrazine?
1-(2-fluorophenyl)dodecylhydrazine has a molecular weight of 294.46 g/mol, XLogP of 5.25, 12 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)dodecylhydrazine is sourced from PubChem (CID 105292285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).