[2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine

C12H15FN4O — CID 105252342

IUPAC[2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
SMILESCOc1cccc(CC(NN)c2ncc[nH]2)c1F
InChIInChI=1S/C12H15FN4O/c1-18-10-4-2-3-8(11(10)13)7-9(17-14)12-15-5-6-16-12/h2-6,9,17H,7,14H2,1H3,(H,15,16)
InChIKeyQKQMXPJDWRLLMW-UHFFFAOYSA-N
MW250.28 g/mol
LogP1.30
Rot. Bonds5

About [2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine

[2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine (PubChem CID 105252342) has the molecular formula C12H15FN4O and a molecular weight of 250.28 g/mol. Its IUPAC name is [2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
PubChem CID105252342
Molecular FormulaC12H15FN4O
Molecular Weight250.28 g/mol
Exact Mass250.12
IUPAC Name[2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
SMILESCOc1cccc(CC(NN)c2ncc[nH]2)c1F
InChIInChI=1S/C12H15FN4O/c1-18-10-4-2-3-8(11(10)13)7-9(17-14)12-15-5-6-16-12/h2-6,9,17H,7,14H2,1H3,(H,15,16)
InChIKeyQKQMXPJDWRLLMW-UHFFFAOYSA-N
XLogP1.30
TPSA75.96 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.28
LogP ≤ 51.30
H-Bond Donors ≤ 53
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-(2-bromo-3-fluorophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
CID 105252067
[2-(2-bromo-5-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
CID 105252149
[1-(3,5-difluorophenyl)-2-(2-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105207998
[1-(2-chlorophenyl)-2-(2-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105211219
2-(2-fluoro-3-methoxyphenyl)-1-pyrimidin-2-ylethanol
CID 104793572
[2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine
CID 105334201
[1-(3-chlorophenyl)-2-(2-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105194806
[2-(2-fluoro-3-methoxyphenyl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine
CID 105228535
[2-(2-fluoro-3-methoxyphenyl)-1-(2-fluoro-5-methylphenyl)ethyl]hydrazine
CID 105334210
[1-(2,5-dichlorophenyl)-2-(2-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105334244
[2-(2,5-dimethylphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
CID 105252049
[1-(2-fluoro-3-methoxyphenyl)-3-methylpentan-2-yl]hydrazine
CID 105219814

Frequently Asked Questions

What is the IUPAC name of [2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine (CID 105252342) is [2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine is COc1cccc(CC(NN)c2ncc[nH]2)c1F.
What is the InChIKey of [2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine?
The InChIKey is QKQMXPJDWRLLMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN4O/c1-18-10-4-2-3-8(11(10)13)7-9(17-14)12-15-5-6-16-12/h2-6,9,17H,7,14H2,1H3,(H,15,16).
What are the key properties of [2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine?
[2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine has a molecular weight of 250.28 g/mol, XLogP of 1.30, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105252342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).