[2-(1-ethylimidazol-2-yl)-1-(4-fluorophenyl)ethyl]hydrazine

C13H17FN4 — CID 105192874

IUPAC[2-(1-ethylimidazol-2-yl)-1-(4-fluorophenyl)ethyl]hydrazine
SMILESCCn1ccnc1CC(NN)c1ccc(F)cc1
InChIInChI=1S/C13H17FN4/c1-2-18-8-7-16-13(18)9-12(17-15)10-3-5-11(14)6-4-10/h3-8,12,17H,2,9,15H2,1H3
InChIKeyQKDUTLGZGIYIIW-UHFFFAOYSA-N
MW248.31 g/mol
LogP1.79
Rot. Bonds5

About [2-(1-ethylimidazol-2-yl)-1-(4-fluorophenyl)ethyl]hydrazine

[2-(1-ethylimidazol-2-yl)-1-(4-fluorophenyl)ethyl]hydrazine (PubChem CID 105192874) has the molecular formula C13H17FN4 and a molecular weight of 248.31 g/mol. Its IUPAC name is [2-(1-ethylimidazol-2-yl)-1-(4-fluorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(1-ethylimidazol-2-yl)-1-(4-fluorophenyl)ethyl]hydrazine
PubChem CID105192874
Molecular FormulaC13H17FN4
Molecular Weight248.31 g/mol
Exact Mass248.14
IUPAC Name[2-(1-ethylimidazol-2-yl)-1-(4-fluorophenyl)ethyl]hydrazine
SMILESCCn1ccnc1CC(NN)c1ccc(F)cc1
InChIInChI=1S/C13H17FN4/c1-2-18-8-7-16-13(18)9-12(17-15)10-3-5-11(14)6-4-10/h3-8,12,17H,2,9,15H2,1H3
InChIKeyQKDUTLGZGIYIIW-UHFFFAOYSA-N
XLogP1.79
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.31
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

[2-(1-ethylimidazol-2-yl)-1-(5-fluoro-2-pyridinyl)ethyl]hydrazine
CID 105248555
[2-(1-ethylimidazol-2-yl)-1-(4-methylsulfonylphenyl)ethyl]hydrazine
CID 105321777
[1-(6-chloro-3-pyridinyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
CID 105253214
[2-(1-ethylimidazol-2-yl)-1-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine
CID 105321910
[2-(1-ethylimidazol-2-yl)-1-(2-fluoro-3-methylphenyl)ethyl]hydrazine
CID 105321923
[1-(4-iodophenyl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine
CID 105323447
[1-(2-ethoxyphenyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
CID 105260835
[1-(5-bromo-2-fluorophenyl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
CID 105280778
[2-(1-ethylimidazol-2-yl)-1-[2-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105321898
[1-(5-bromofuran-2-yl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
CID 105321933
N-ethyl-1-(1-ethylimidazol-2-yl)-3-(4-fluorophenyl)propan-2-amine
CID 79752901
[2-(1-ethylimidazol-2-yl)-1-(2-fluoro-4-methoxyphenyl)ethyl]hydrazine
CID 105257015

Frequently Asked Questions

What is the IUPAC name of [2-(1-ethylimidazol-2-yl)-1-(4-fluorophenyl)ethyl]hydrazine?
The IUPAC name of [2-(1-ethylimidazol-2-yl)-1-(4-fluorophenyl)ethyl]hydrazine (CID 105192874) is [2-(1-ethylimidazol-2-yl)-1-(4-fluorophenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(1-ethylimidazol-2-yl)-1-(4-fluorophenyl)ethyl]hydrazine?
The canonical SMILES for [2-(1-ethylimidazol-2-yl)-1-(4-fluorophenyl)ethyl]hydrazine is CCn1ccnc1CC(NN)c1ccc(F)cc1.
What is the InChIKey of [2-(1-ethylimidazol-2-yl)-1-(4-fluorophenyl)ethyl]hydrazine?
The InChIKey is QKDUTLGZGIYIIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN4/c1-2-18-8-7-16-13(18)9-12(17-15)10-3-5-11(14)6-4-10/h3-8,12,17H,2,9,15H2,1H3.
What are the key properties of [2-(1-ethylimidazol-2-yl)-1-(4-fluorophenyl)ethyl]hydrazine?
[2-(1-ethylimidazol-2-yl)-1-(4-fluorophenyl)ethyl]hydrazine has a molecular weight of 248.31 g/mol, XLogP of 1.79, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-ethylimidazol-2-yl)-1-(4-fluorophenyl)ethyl]hydrazine is sourced from PubChem (CID 105192874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).