[2-(1-methylimidazol-2-yl)-1-(2,4,6-trifluorophenyl)ethyl]hydrazine

C12H13F3N4 — CID 105322975

IUPAC[2-(1-methylimidazol-2-yl)-1-(2,4,6-trifluorophenyl)ethyl]hydrazine
SMILESCn1ccnc1CC(NN)c1c(F)cc(F)cc1F
InChIInChI=1S/C12H13F3N4/c1-19-3-2-17-11(19)6-10(18-16)12-8(14)4-7(13)5-9(12)15/h2-5,10,18H,6,16H2,1H3
InChIKeyJAFPFWUUJDIJPN-UHFFFAOYSA-N
MW270.26 g/mol
LogP1.58
Rot. Bonds4

About [2-(1-methylimidazol-2-yl)-1-(2,4,6-trifluorophenyl)ethyl]hydrazine

[2-(1-methylimidazol-2-yl)-1-(2,4,6-trifluorophenyl)ethyl]hydrazine (PubChem CID 105322975) has the molecular formula C12H13F3N4 and a molecular weight of 270.26 g/mol. Its IUPAC name is [2-(1-methylimidazol-2-yl)-1-(2,4,6-trifluorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(1-methylimidazol-2-yl)-1-(2,4,6-trifluorophenyl)ethyl]hydrazine
PubChem CID105322975
Molecular FormulaC12H13F3N4
Molecular Weight270.26 g/mol
Exact Mass270.11
IUPAC Name[2-(1-methylimidazol-2-yl)-1-(2,4,6-trifluorophenyl)ethyl]hydrazine
SMILESCn1ccnc1CC(NN)c1c(F)cc(F)cc1F
InChIInChI=1S/C12H13F3N4/c1-19-3-2-17-11(19)6-10(18-16)12-8(14)4-7(13)5-9(12)15/h2-5,10,18H,6,16H2,1H3
InChIKeyJAFPFWUUJDIJPN-UHFFFAOYSA-N
XLogP1.58
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.26
LogP ≤ 51.58
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

[3-(1-methylimidazol-2-yl)-1-(2,4,6-trifluorophenyl)propyl]hydrazine
CID 105340372
N-[2-(1-methylimidazol-2-yl)-1-(2,4,6-trifluorophenyl)ethyl]propan-1-amine
CID 105011526
[1-(2,4-difluoro-5-methylphenyl)-2-(1-methylimidazol-2-yl)ethyl]hydrazine
CID 105322993
[1-(4-chloro-2-fluorophenyl)-2-(1-methylimidazol-2-yl)ethyl]hydrazine
CID 105217996
[1-(2-chloro-3-fluorophenyl)-2-(1-methylimidazol-2-yl)ethyl]hydrazine
CID 105322944
[1-(2,5-dimethylphenyl)-2-(1-methylimidazol-2-yl)ethyl]hydrazine
CID 105322911
[1-(3,5-dimethyl-2-pyridinyl)-2-(1-methylimidazol-2-yl)ethyl]hydrazine
CID 105266557
[1-(3,6-dimethylpyridazin-4-yl)-2-(1-methylimidazol-2-yl)ethyl]hydrazine
CID 105323024
[2-(1-methylimidazol-2-yl)-1-(3-methyl-4-pyridinyl)ethyl]hydrazine
CID 105262020
1-(2,5-difluorophenyl)-N-ethyl-2-(1-methylimidazol-2-yl)ethanamine
CID 79751985
[1-(3-bromo-2-fluorophenyl)-2-(1-methylimidazol-2-yl)ethyl]hydrazine
CID 107954276
1-(2,4-difluorophenyl)-N-ethyl-3-(1-methylimidazol-2-yl)propan-2-amine
CID 79761359

Frequently Asked Questions

What is the IUPAC name of [2-(1-methylimidazol-2-yl)-1-(2,4,6-trifluorophenyl)ethyl]hydrazine?
The IUPAC name of [2-(1-methylimidazol-2-yl)-1-(2,4,6-trifluorophenyl)ethyl]hydrazine (CID 105322975) is [2-(1-methylimidazol-2-yl)-1-(2,4,6-trifluorophenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(1-methylimidazol-2-yl)-1-(2,4,6-trifluorophenyl)ethyl]hydrazine?
The canonical SMILES for [2-(1-methylimidazol-2-yl)-1-(2,4,6-trifluorophenyl)ethyl]hydrazine is Cn1ccnc1CC(NN)c1c(F)cc(F)cc1F.
What is the InChIKey of [2-(1-methylimidazol-2-yl)-1-(2,4,6-trifluorophenyl)ethyl]hydrazine?
The InChIKey is JAFPFWUUJDIJPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13F3N4/c1-19-3-2-17-11(19)6-10(18-16)12-8(14)4-7(13)5-9(12)15/h2-5,10,18H,6,16H2,1H3.
What are the key properties of [2-(1-methylimidazol-2-yl)-1-(2,4,6-trifluorophenyl)ethyl]hydrazine?
[2-(1-methylimidazol-2-yl)-1-(2,4,6-trifluorophenyl)ethyl]hydrazine has a molecular weight of 270.26 g/mol, XLogP of 1.58, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-methylimidazol-2-yl)-1-(2,4,6-trifluorophenyl)ethyl]hydrazine is sourced from PubChem (CID 105322975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).