[(2-chloro-6-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine

C11H12ClFN4 — CID 105308170

IUPAC[(2-chloro-6-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine
SMILESCn1ccnc1C(NN)c1c(F)cccc1Cl
InChIInChI=1S/C11H12ClFN4/c1-17-6-5-15-11(17)10(16-14)9-7(12)3-2-4-8(9)13/h2-6,10,16H,14H2,1H3
InChIKeyNPICNXILYIFONP-UHFFFAOYSA-N
MW254.70 g/mol
LogP1.77
Rot. Bonds3

About [(2-chloro-6-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine

[(2-chloro-6-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine (PubChem CID 105308170) has the molecular formula C11H12ClFN4 and a molecular weight of 254.70 g/mol. Its IUPAC name is [(2-chloro-6-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-chloro-6-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine
PubChem CID105308170
Molecular FormulaC11H12ClFN4
Molecular Weight254.70 g/mol
Exact Mass254.07
IUPAC Name[(2-chloro-6-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine
SMILESCn1ccnc1C(NN)c1c(F)cccc1Cl
InChIInChI=1S/C11H12ClFN4/c1-17-6-5-15-11(17)10(16-14)9-7(12)3-2-4-8(9)13/h2-6,10,16H,14H2,1H3
InChIKeyNPICNXILYIFONP-UHFFFAOYSA-N
XLogP1.77
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.70
LogP ≤ 51.77
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-chloro-6-fluorophenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine
CID 103140976
[(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine
CID 105192712
bis(1-methylimidazol-2-yl)methylhydrazine
CID 105258117
[(2-chloro-6-fluorophenyl)-(2-ethylpyrazol-3-yl)methyl]hydrazine
CID 105307110
2-[1-(2,6-difluorophenyl)ethyl]-1-methylimidazole
CID 70942543
[(2-fluoro-4,6-dimethylphenyl)-(1-methylimidazol-2-yl)methyl]hydrazine
CID 106884398
[(2-chloro-6-fluorophenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine
CID 105288642
N-[(2-chloro-6-fluorophenyl)-(1-propylimidazol-2-yl)methyl]propan-1-amine
CID 61317545
[(1-methylimidazol-2-yl)-pyrimidin-2-ylmethyl]hydrazine
CID 105203671
[(2-chloro-6-fluorophenyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine
CID 114275504
1-(2-chloro-6-fluorophenyl)-N-ethyl-2-(1-methylimidazol-2-yl)ethanamine
CID 105011269
N-[(2-chloro-3-fluorophenyl)-(1-methylimidazol-2-yl)methyl]ethanamine
CID 81462073

Frequently Asked Questions

What is the IUPAC name of [(2-chloro-6-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine?
The IUPAC name of [(2-chloro-6-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine (CID 105308170) is [(2-chloro-6-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine.
What is the SMILES notation for [(2-chloro-6-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine?
The canonical SMILES for [(2-chloro-6-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine is Cn1ccnc1C(NN)c1c(F)cccc1Cl.
What is the InChIKey of [(2-chloro-6-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine?
The InChIKey is NPICNXILYIFONP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClFN4/c1-17-6-5-15-11(17)10(16-14)9-7(12)3-2-4-8(9)13/h2-6,10,16H,14H2,1H3.
What are the key properties of [(2-chloro-6-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine?
[(2-chloro-6-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine has a molecular weight of 254.70 g/mol, XLogP of 1.77, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-chloro-6-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine is sourced from PubChem (CID 105308170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).