[(2-fluoro-5-methylphenyl)-(1-methylimidazol-4-yl)methyl]hydrazine

C12H15FN4 — CID 107979071

IUPAC[(2-fluoro-5-methylphenyl)-(1-methylimidazol-4-yl)methyl]hydrazine
SMILESCc1ccc(F)c(C(NN)c2cn(C)cn2)c1
InChIInChI=1S/C12H15FN4/c1-8-3-4-10(13)9(5-8)12(16-14)11-6-17(2)7-15-11/h3-7,12,16H,14H2,1-2H3
InChIKeyIJMCJDVXTRWPQL-UHFFFAOYSA-N
MW234.28 g/mol
LogP1.42
Rot. Bonds3

About [(2-fluoro-5-methylphenyl)-(1-methylimidazol-4-yl)methyl]hydrazine

[(2-fluoro-5-methylphenyl)-(1-methylimidazol-4-yl)methyl]hydrazine (PubChem CID 107979071) has the molecular formula C12H15FN4 and a molecular weight of 234.28 g/mol. Its IUPAC name is [(2-fluoro-5-methylphenyl)-(1-methylimidazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-fluoro-5-methylphenyl)-(1-methylimidazol-4-yl)methyl]hydrazine
PubChem CID107979071
Molecular FormulaC12H15FN4
Molecular Weight234.28 g/mol
Exact Mass234.13
IUPAC Name[(2-fluoro-5-methylphenyl)-(1-methylimidazol-4-yl)methyl]hydrazine
SMILESCc1ccc(F)c(C(NN)c2cn(C)cn2)c1
InChIInChI=1S/C12H15FN4/c1-8-3-4-10(13)9(5-8)12(16-14)11-6-17(2)7-15-11/h3-7,12,16H,14H2,1-2H3
InChIKeyIJMCJDVXTRWPQL-UHFFFAOYSA-N
XLogP1.42
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.28
LogP ≤ 51.42
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

[(3,4-difluorophenyl)-(1-methylimidazol-4-yl)methyl]hydrazine
CID 107979097
[(1-methylimidazol-4-yl)-(2,4,5-trimethylphenyl)methyl]hydrazine
CID 107979173
1-(2,5-difluorophenyl)-N-methyl-1-(1-methylimidazol-4-yl)methanamine
CID 107974970
[(2-fluoro-5-methylphenyl)-pyrimidin-4-ylmethyl]hydrazine
CID 105220915
[(2-fluoro-5-methylphenyl)-quinoxalin-2-ylmethyl]hydrazine
CID 107357861
[(2-fluoro-5-methylphenyl)-(4-methylphenyl)methyl]hydrazine
CID 105194262
[(2,6-difluoro-3-methylphenyl)-(2-fluoro-5-methylphenyl)methyl]hydrazine
CID 105302737
[(1,3-diethylpyrazol-5-yl)-(2-fluoro-5-methylphenyl)methyl]hydrazine
CID 105302786
1-(1-methylimidazol-4-yl)ethylhydrazine
CID 107978855
[(2-fluoro-4,6-dimethylphenyl)-(2-fluoro-5-methylphenyl)methyl]hydrazine
CID 106884601
[(2,5-difluorophenyl)-(2,5-dimethylphenyl)methyl]hydrazine
CID 105219377
1-(2-fluoro-5-methylphenyl)-N-methyl-1-(1-methylpyrazol-3-yl)methanamine
CID 65200840

Frequently Asked Questions

What is the IUPAC name of [(2-fluoro-5-methylphenyl)-(1-methylimidazol-4-yl)methyl]hydrazine?
The IUPAC name of [(2-fluoro-5-methylphenyl)-(1-methylimidazol-4-yl)methyl]hydrazine (CID 107979071) is [(2-fluoro-5-methylphenyl)-(1-methylimidazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [(2-fluoro-5-methylphenyl)-(1-methylimidazol-4-yl)methyl]hydrazine?
The canonical SMILES for [(2-fluoro-5-methylphenyl)-(1-methylimidazol-4-yl)methyl]hydrazine is Cc1ccc(F)c(C(NN)c2cn(C)cn2)c1.
What is the InChIKey of [(2-fluoro-5-methylphenyl)-(1-methylimidazol-4-yl)methyl]hydrazine?
The InChIKey is IJMCJDVXTRWPQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN4/c1-8-3-4-10(13)9(5-8)12(16-14)11-6-17(2)7-15-11/h3-7,12,16H,14H2,1-2H3.
What are the key properties of [(2-fluoro-5-methylphenyl)-(1-methylimidazol-4-yl)methyl]hydrazine?
[(2-fluoro-5-methylphenyl)-(1-methylimidazol-4-yl)methyl]hydrazine has a molecular weight of 234.28 g/mol, XLogP of 1.42, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-fluoro-5-methylphenyl)-(1-methylimidazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 107979071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).