[2-(2,5-dimethylphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine

C13H18N4 — CID 105252049

IUPAC[2-(2,5-dimethylphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
SMILESCc1ccc(C)c(CC(NN)c2ncc[nH]2)c1
InChIInChI=1S/C13H18N4/c1-9-3-4-10(2)11(7-9)8-12(17-14)13-15-5-6-16-13/h3-7,12,17H,8,14H2,1-2H3,(H,15,16)
InChIKeyOWMXRSUAOUXCGJ-UHFFFAOYSA-N
MW230.31 g/mol
LogP1.77
Rot. Bonds4

About [2-(2,5-dimethylphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine

[2-(2,5-dimethylphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine (PubChem CID 105252049) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is [2-(2,5-dimethylphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2,5-dimethylphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
PubChem CID105252049
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name[2-(2,5-dimethylphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
SMILESCc1ccc(C)c(CC(NN)c2ncc[nH]2)c1
InChIInChI=1S/C13H18N4/c1-9-3-4-10(2)11(7-9)8-12(17-14)13-15-5-6-16-13/h3-7,12,17H,8,14H2,1-2H3,(H,15,16)
InChIKeyOWMXRSUAOUXCGJ-UHFFFAOYSA-N
XLogP1.77
TPSA66.73 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 51.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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-(2,5-dimethylphenyl)-1-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 105287730
[2-(2-bromo-5-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
CID 105252149
1-(2,5-dimethylphenyl)-3-(1H-imidazol-2-yl)-N-methylpropan-2-amine
CID 62538180
[2-(4-bromophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
CID 105252268
[1-(4-bromo-3,5-dimethylphenyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine
CID 105279428
[1-(2-chloro-4-methylphenyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine
CID 106859721
1-(1H-imidazol-2-yl)hex-4-ynylhydrazine
CID 105252218
[2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
CID 105252342
[1-(3-chloro-4-pyridinyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine
CID 105287759
[2-(2-bromo-3-fluorophenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
CID 105252067
[1-(2,6-dichlorophenyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine
CID 105287728
[2-(2,5-dimethylphenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine
CID 105287695

Frequently Asked Questions

What is the IUPAC name of [2-(2,5-dimethylphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(2,5-dimethylphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine (CID 105252049) is [2-(2,5-dimethylphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2,5-dimethylphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2,5-dimethylphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine is Cc1ccc(C)c(CC(NN)c2ncc[nH]2)c1.
What is the InChIKey of [2-(2,5-dimethylphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine?
The InChIKey is OWMXRSUAOUXCGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-9-3-4-10(2)11(7-9)8-12(17-14)13-15-5-6-16-13/h3-7,12,17H,8,14H2,1-2H3,(H,15,16).
What are the key properties of [2-(2,5-dimethylphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine?
[2-(2,5-dimethylphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine has a molecular weight of 230.31 g/mol, XLogP of 1.77, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,5-dimethylphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105252049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).