[1-(2-fluorophenyl)-3-methylbutyl]hydrazine

C11H17FN2 — CID 105198906

IUPAC[1-(2-fluorophenyl)-3-methylbutyl]hydrazine
SMILESCC(C)CC(NN)c1ccccc1F
InChIInChI=1S/C11H17FN2/c1-8(2)7-11(14-13)9-5-3-4-6-10(9)12/h3-6,8,11,14H,7,13H2,1-2H3
InChIKeyBCBJOBMOIPTPCN-UHFFFAOYSA-N
MW196.27 g/mol
LogP2.38
Rot. Bonds4

About [1-(2-fluorophenyl)-3-methylbutyl]hydrazine

[1-(2-fluorophenyl)-3-methylbutyl]hydrazine (PubChem CID 105198906) has the molecular formula C11H17FN2 and a molecular weight of 196.27 g/mol. Its IUPAC name is [1-(2-fluorophenyl)-3-methylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(2-fluorophenyl)-3-methylbutyl]hydrazine
PubChem CID105198906
Molecular FormulaC11H17FN2
Molecular Weight196.27 g/mol
Exact Mass196.14
IUPAC Name[1-(2-fluorophenyl)-3-methylbutyl]hydrazine
SMILESCC(C)CC(NN)c1ccccc1F
InChIInChI=1S/C11H17FN2/c1-8(2)7-11(14-13)9-5-3-4-6-10(9)12/h3-6,8,11,14H,7,13H2,1-2H3
InChIKeyBCBJOBMOIPTPCN-UHFFFAOYSA-N
XLogP2.38
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.27
LogP ≤ 52.38
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'}

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Frequently Asked Questions

What is the IUPAC name of [1-(2-fluorophenyl)-3-methylbutyl]hydrazine?
The IUPAC name of [1-(2-fluorophenyl)-3-methylbutyl]hydrazine (CID 105198906) is [1-(2-fluorophenyl)-3-methylbutyl]hydrazine.
What is the SMILES notation for [1-(2-fluorophenyl)-3-methylbutyl]hydrazine?
The canonical SMILES for [1-(2-fluorophenyl)-3-methylbutyl]hydrazine is CC(C)CC(NN)c1ccccc1F.
What is the InChIKey of [1-(2-fluorophenyl)-3-methylbutyl]hydrazine?
The InChIKey is BCBJOBMOIPTPCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17FN2/c1-8(2)7-11(14-13)9-5-3-4-6-10(9)12/h3-6,8,11,14H,7,13H2,1-2H3.
What are the key properties of [1-(2-fluorophenyl)-3-methylbutyl]hydrazine?
[1-(2-fluorophenyl)-3-methylbutyl]hydrazine has a molecular weight of 196.27 g/mol, XLogP of 2.38, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-fluorophenyl)-3-methylbutyl]hydrazine is sourced from PubChem (CID 105198906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).