[(1-ethylimidazol-2-yl)-(2,3,4,5,6-pentafluorophenyl)methyl]hydrazine

C12H11F5N4 — CID 105308467

IUPAC[(1-ethylimidazol-2-yl)-(2,3,4,5,6-pentafluorophenyl)methyl]hydrazine
SMILESCCn1ccnc1C(NN)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C12H11F5N4/c1-2-21-4-3-19-12(21)11(20-18)5-6(13)8(15)10(17)9(16)7(5)14/h3-4,11,20H,2,18H2,1H3
InChIKeyFZRFPRFQBYQOPG-UHFFFAOYSA-N
MW306.24 g/mol
LogP2.15
Rot. Bonds4

About [(1-ethylimidazol-2-yl)-(2,3,4,5,6-pentafluorophenyl)methyl]hydrazine

[(1-ethylimidazol-2-yl)-(2,3,4,5,6-pentafluorophenyl)methyl]hydrazine (PubChem CID 105308467) has the molecular formula C12H11F5N4 and a molecular weight of 306.24 g/mol. Its IUPAC name is [(1-ethylimidazol-2-yl)-(2,3,4,5,6-pentafluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(1-ethylimidazol-2-yl)-(2,3,4,5,6-pentafluorophenyl)methyl]hydrazine
PubChem CID105308467
Molecular FormulaC12H11F5N4
Molecular Weight306.24 g/mol
Exact Mass306.09
IUPAC Name[(1-ethylimidazol-2-yl)-(2,3,4,5,6-pentafluorophenyl)methyl]hydrazine
SMILESCCn1ccnc1C(NN)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C12H11F5N4/c1-2-21-4-3-19-12(21)11(20-18)5-6(13)8(15)10(17)9(16)7(5)14/h3-4,11,20H,2,18H2,1H3
InChIKeyFZRFPRFQBYQOPG-UHFFFAOYSA-N
XLogP2.15
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.24
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', '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-ethylimidazol-2-yl)-(2,3,4,5,6-pentafluorophenyl)methanamine
CID 61315339
[(2-chloro-4-fluorophenyl)-(1-ethylimidazol-2-yl)methyl]hydrazine
CID 105215277
[(1-propylimidazol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105307552
[1-(1-ethylimidazol-2-yl)-3-methylbutyl]hydrazine
CID 105198831
[(1-ethylimidazol-2-yl)-(thiadiazol-5-yl)methyl]hydrazine
CID 105308372
[(1-ethylimidazol-2-yl)-pyridin-3-ylmethyl]hydrazine
CID 105196054
[(1-ethylimidazol-2-yl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine
CID 105308543
[(2,5-dimethylfuran-3-yl)-(1-ethylimidazol-2-yl)methyl]hydrazine
CID 105308447
[(3,5-dimethyl-2-pyridinyl)-(1-ethylimidazol-2-yl)methyl]hydrazine
CID 105266290
[(1-ethylimidazol-2-yl)-(4-propylthiadiazol-5-yl)methyl]hydrazine
CID 105308426
[(3-bromo-4-methylphenyl)-(1-ethylimidazol-2-yl)methyl]hydrazine
CID 105308418
[(3-chloro-5-methylphenyl)-(1-ethylimidazol-2-yl)methyl]hydrazine
CID 105308375

Frequently Asked Questions

What is the IUPAC name of [(1-ethylimidazol-2-yl)-(2,3,4,5,6-pentafluorophenyl)methyl]hydrazine?
The IUPAC name of [(1-ethylimidazol-2-yl)-(2,3,4,5,6-pentafluorophenyl)methyl]hydrazine (CID 105308467) is [(1-ethylimidazol-2-yl)-(2,3,4,5,6-pentafluorophenyl)methyl]hydrazine.
What is the SMILES notation for [(1-ethylimidazol-2-yl)-(2,3,4,5,6-pentafluorophenyl)methyl]hydrazine?
The canonical SMILES for [(1-ethylimidazol-2-yl)-(2,3,4,5,6-pentafluorophenyl)methyl]hydrazine is CCn1ccnc1C(NN)c1c(F)c(F)c(F)c(F)c1F.
What is the InChIKey of [(1-ethylimidazol-2-yl)-(2,3,4,5,6-pentafluorophenyl)methyl]hydrazine?
The InChIKey is FZRFPRFQBYQOPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F5N4/c1-2-21-4-3-19-12(21)11(20-18)5-6(13)8(15)10(17)9(16)7(5)14/h3-4,11,20H,2,18H2,1H3.
What are the key properties of [(1-ethylimidazol-2-yl)-(2,3,4,5,6-pentafluorophenyl)methyl]hydrazine?
[(1-ethylimidazol-2-yl)-(2,3,4,5,6-pentafluorophenyl)methyl]hydrazine has a molecular weight of 306.24 g/mol, XLogP of 2.15, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(1-ethylimidazol-2-yl)-(2,3,4,5,6-pentafluorophenyl)methyl]hydrazine is sourced from PubChem (CID 105308467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).