[1-(3-fluorophenyl)-3-methylpentan-2-yl]hydrazine

C12H19FN2 — CID 105204829

IUPAC[1-(3-fluorophenyl)-3-methylpentan-2-yl]hydrazine
SMILESCCC(C)C(Cc1cccc(F)c1)NN
InChIInChI=1S/C12H19FN2/c1-3-9(2)12(15-14)8-10-5-4-6-11(13)7-10/h4-7,9,12,15H,3,8,14H2,1-2H3
InChIKeyKJJZFSLLJKKJTQ-UHFFFAOYSA-N
MW210.30 g/mol
LogP2.25
Rot. Bonds5

About [1-(3-fluorophenyl)-3-methylpentan-2-yl]hydrazine

[1-(3-fluorophenyl)-3-methylpentan-2-yl]hydrazine (PubChem CID 105204829) has the molecular formula C12H19FN2 and a molecular weight of 210.30 g/mol. Its IUPAC name is [1-(3-fluorophenyl)-3-methylpentan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3-fluorophenyl)-3-methylpentan-2-yl]hydrazine
PubChem CID105204829
Molecular FormulaC12H19FN2
Molecular Weight210.30 g/mol
Exact Mass210.15
IUPAC Name[1-(3-fluorophenyl)-3-methylpentan-2-yl]hydrazine
SMILESCCC(C)C(Cc1cccc(F)c1)NN
InChIInChI=1S/C12H19FN2/c1-3-9(2)12(15-14)8-10-5-4-6-11(13)7-10/h4-7,9,12,15H,3,8,14H2,1-2H3
InChIKeyKJJZFSLLJKKJTQ-UHFFFAOYSA-N
XLogP2.25
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 52.25
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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Related Compounds

[1-(3-fluorophenyl)-3-methylhexan-2-yl]hydrazine
CID 105286424
[1-(3-fluorophenyl)-3-propylhexan-2-yl]hydrazine
CID 105286352
[1-(3,4-difluorophenyl)-3-methylpentan-2-yl]hydrazine
CID 105219724
[1-ethoxy-3-(3-fluorophenyl)-1-phenylpropan-2-yl]hydrazine
CID 105279229
1-fluoro-3-[(2S)-2-methylbutyl]benzene
CID 125477231
[1-(3,4-dimethylphenyl)-3-methylpentan-2-yl]hydrazine
CID 105215198
3-ethoxy-1-(3-fluorophenyl)-N-methylbutan-2-amine
CID 64532588
[1-(3-fluorophenyl)-3,3-dimethylpentan-2-yl]hydrazine
CID 105286476
1-(2-ethyl-3-methylbutyl)-3-fluorobenzene
CID 139973435
[1-(3-fluorophenyl)-3-(3-methoxyphenyl)propan-2-yl]hydrazine
CID 105204868
[1-(3-bromophenyl)-3-methylhexan-2-yl]hydrazine
CID 105284586
N-ethyl-1-(3-fluorophenyl)-3-propylhexan-2-amine
CID 82987589

Frequently Asked Questions

What is the IUPAC name of [1-(3-fluorophenyl)-3-methylpentan-2-yl]hydrazine?
The IUPAC name of [1-(3-fluorophenyl)-3-methylpentan-2-yl]hydrazine (CID 105204829) is [1-(3-fluorophenyl)-3-methylpentan-2-yl]hydrazine.
What is the SMILES notation for [1-(3-fluorophenyl)-3-methylpentan-2-yl]hydrazine?
The canonical SMILES for [1-(3-fluorophenyl)-3-methylpentan-2-yl]hydrazine is CCC(C)C(Cc1cccc(F)c1)NN.
What is the InChIKey of [1-(3-fluorophenyl)-3-methylpentan-2-yl]hydrazine?
The InChIKey is KJJZFSLLJKKJTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19FN2/c1-3-9(2)12(15-14)8-10-5-4-6-11(13)7-10/h4-7,9,12,15H,3,8,14H2,1-2H3.
What are the key properties of [1-(3-fluorophenyl)-3-methylpentan-2-yl]hydrazine?
[1-(3-fluorophenyl)-3-methylpentan-2-yl]hydrazine has a molecular weight of 210.30 g/mol, XLogP of 2.25, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-fluorophenyl)-3-methylpentan-2-yl]hydrazine is sourced from PubChem (CID 105204829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).