[1-(3-fluoro-5-methylphenyl)-3-methylidenepentyl]hydrazine

C13H19FN2 — CID 105257527

IUPAC[1-(3-fluoro-5-methylphenyl)-3-methylidenepentyl]hydrazine
SMILESC=C(CC)CC(NN)c1cc(C)cc(F)c1
InChIInChI=1S/C13H19FN2/c1-4-9(2)7-13(16-15)11-5-10(3)6-12(14)8-11/h5-6,8,13,16H,2,4,7,15H2,1,3H3
InChIKeyPZTDHWWTGHNQCC-UHFFFAOYSA-N
MW222.31 g/mol
LogP2.99
Rot. Bonds5

About [1-(3-fluoro-5-methylphenyl)-3-methylidenepentyl]hydrazine

[1-(3-fluoro-5-methylphenyl)-3-methylidenepentyl]hydrazine (PubChem CID 105257527) has the molecular formula C13H19FN2 and a molecular weight of 222.31 g/mol. Its IUPAC name is [1-(3-fluoro-5-methylphenyl)-3-methylidenepentyl]hydrazine.

Molecular Properties

Compound Name[1-(3-fluoro-5-methylphenyl)-3-methylidenepentyl]hydrazine
PubChem CID105257527
Molecular FormulaC13H19FN2
Molecular Weight222.31 g/mol
Exact Mass222.15
IUPAC Name[1-(3-fluoro-5-methylphenyl)-3-methylidenepentyl]hydrazine
SMILESC=C(CC)CC(NN)c1cc(C)cc(F)c1
InChIInChI=1S/C13H19FN2/c1-4-9(2)7-13(16-15)11-5-10(3)6-12(14)8-11/h5-6,8,13,16H,2,4,7,15H2,1,3H3
InChIKeyPZTDHWWTGHNQCC-UHFFFAOYSA-N
XLogP2.99
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(3-methylidene-1-phenylpentyl)hydrazine
CID 105199375
1-(3-bromo-5-fluorophenyl)-N-methyl-3-methylidenepentan-1-amine
CID 66424843
[4,4,4-trifluoro-1-(3-fluoro-5-methylphenyl)butyl]hydrazine
CID 105249105
[1-(4-bromo-2,6-difluorophenyl)-3-methylidenepentyl]hydrazine
CID 105320470
[3-ethoxy-1-(3-fluoro-5-methylphenyl)propyl]hydrazine
CID 105325359
1-(3,5-difluorophenyl)propylhydrazine
CID 53402270
[1-(3-chloro-5-methylphenyl)-3-methylbut-3-enyl]hydrazine
CID 105319456
[1-(furan-3-yl)-3-methylidenepentyl]hydrazine
CID 105221421
[1-(2-chloro-4-methylphenyl)-3-methylidenepentyl]hydrazine
CID 106860054
[1-(3-chloro-4,5-dimethoxyphenyl)-3-methylidenepentyl]hydrazine
CID 105204631
[1-(4-bromo-2-fluorophenyl)-3-methylidenepentyl]hydrazine
CID 105281036
[1-(3-fluoro-5-methylphenyl)-3-methylsulfonylpropyl]hydrazine
CID 114984862

Frequently Asked Questions

What is the IUPAC name of [1-(3-fluoro-5-methylphenyl)-3-methylidenepentyl]hydrazine?
The IUPAC name of [1-(3-fluoro-5-methylphenyl)-3-methylidenepentyl]hydrazine (CID 105257527) is [1-(3-fluoro-5-methylphenyl)-3-methylidenepentyl]hydrazine.
What is the SMILES notation for [1-(3-fluoro-5-methylphenyl)-3-methylidenepentyl]hydrazine?
The canonical SMILES for [1-(3-fluoro-5-methylphenyl)-3-methylidenepentyl]hydrazine is C=C(CC)CC(NN)c1cc(C)cc(F)c1.
What is the InChIKey of [1-(3-fluoro-5-methylphenyl)-3-methylidenepentyl]hydrazine?
The InChIKey is PZTDHWWTGHNQCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2/c1-4-9(2)7-13(16-15)11-5-10(3)6-12(14)8-11/h5-6,8,13,16H,2,4,7,15H2,1,3H3.
What are the key properties of [1-(3-fluoro-5-methylphenyl)-3-methylidenepentyl]hydrazine?
[1-(3-fluoro-5-methylphenyl)-3-methylidenepentyl]hydrazine has a molecular weight of 222.31 g/mol, XLogP of 2.99, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-fluoro-5-methylphenyl)-3-methylidenepentyl]hydrazine is sourced from PubChem (CID 105257527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).