[4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine

C11H18FN3O — CID 105335371

IUPAC[4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine
SMILESCCOCCCC(NN)c1ccncc1F
InChIInChI=1S/C11H18FN3O/c1-2-16-7-3-4-11(15-13)9-5-6-14-8-10(9)12/h5-6,8,11,15H,2-4,7,13H2,1H3
InChIKeyHHWUTJRCFZVPJY-UHFFFAOYSA-N
MW227.28 g/mol
LogP1.54
Rot. Bonds7

About [4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine

[4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine (PubChem CID 105335371) has the molecular formula C11H18FN3O and a molecular weight of 227.28 g/mol. Its IUPAC name is [4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine.

Molecular Properties

Compound Name[4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine
PubChem CID105335371
Molecular FormulaC11H18FN3O
Molecular Weight227.28 g/mol
Exact Mass227.14
IUPAC Name[4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine
SMILESCCOCCCC(NN)c1ccncc1F
InChIInChI=1S/C11H18FN3O/c1-2-16-7-3-4-11(15-13)9-5-6-14-8-10(9)12/h5-6,8,11,15H,2-4,7,13H2,1H3
InChIKeyHHWUTJRCFZVPJY-UHFFFAOYSA-N
XLogP1.54
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.28
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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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Related Compounds

[1-(3-fluoro-4-pyridinyl)-3-(2-methoxyethoxy)propyl]hydrazine
CID 102930056
[1-(4-chloro-2-fluorophenyl)-4-ethoxybutyl]hydrazine
CID 105328383
[1-(3-fluoro-4-pyridinyl)-3-pyridin-4-ylpropyl]hydrazine
CID 105335444
1-(3-fluoro-4-pyridinyl)-4-methoxy-N-propylbutan-1-amine
CID 113447246
[1-(3-ethyl-4-pyridinyl)-4-methoxybutyl]hydrazine
CID 105262232
[1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine
CID 105258537
1-(3-methyl-4-pyridinyl)pentylhydrazine
CID 105261719
[2-ethoxy-1-(3-fluoro-4-pyridinyl)propyl]hydrazine
CID 105222856
[2-cyclopropyl-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine
CID 105254097
1-(3-fluoro-4-pyridinyl)-N-methyl-3-propoxypropan-1-amine
CID 105181877
(3-ethoxy-1-isoquinolin-8-ylpropyl)hydrazine
CID 103141619
[3,3,3-trifluoro-1-(3-fluoro-4-pyridinyl)propyl]hydrazine
CID 105206013

Frequently Asked Questions

What is the IUPAC name of [4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine?
The IUPAC name of [4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine (CID 105335371) is [4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine.
What is the SMILES notation for [4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine?
The canonical SMILES for [4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine is CCOCCCC(NN)c1ccncc1F.
What is the InChIKey of [4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine?
The InChIKey is HHWUTJRCFZVPJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18FN3O/c1-2-16-7-3-4-11(15-13)9-5-6-14-8-10(9)12/h5-6,8,11,15H,2-4,7,13H2,1H3.
What are the key properties of [4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine?
[4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine has a molecular weight of 227.28 g/mol, XLogP of 1.54, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine is sourced from PubChem (CID 105335371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).