[2-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine

C13H18N4O — CID 105205136

IUPAC[2-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine
SMILESCOc1cccc(CC(NN)c2ccnn2C)c1
InChIInChI=1S/C13H18N4O/c1-17-13(6-7-15-17)12(16-14)9-10-4-3-5-11(8-10)18-2/h3-8,12,16H,9,14H2,1-2H3
InChIKeyXJPPQELDEPMVIG-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.18
Rot. Bonds5

About [2-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine

[2-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine (PubChem CID 105205136) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is [2-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine
PubChem CID105205136
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC Name[2-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine
SMILESCOc1cccc(CC(NN)c2ccnn2C)c1
InChIInChI=1S/C13H18N4O/c1-17-13(6-7-15-17)12(16-14)9-10-4-3-5-11(8-10)18-2/h3-8,12,16H,9,14H2,1-2H3
InChIKeyXJPPQELDEPMVIG-UHFFFAOYSA-N
XLogP1.18
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-(3,5-dimethylphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine
CID 105212589
[2-(2-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine
CID 105204926
[2-(3-methoxyphenyl)-1-(4-methoxyphenyl)ethyl]hydrazine
CID 105190967
[2-(3-chloro-4-fluorophenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine
CID 103044165
[1-(5-bromofuran-2-yl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105295409
[1-(3-bromo-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105268203
[1-(3-ethyl-2-pyridinyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105263917
[1-(3-ethoxyphenyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105192057
[2-(3-methoxyphenyl)-1-(2-methylsulfanylphenyl)ethyl]hydrazine
CID 105295350
[1-(2-chlorophenyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105205130
1-(2-methylpyrazol-3-yl)propylhydrazine
CID 105200909
[1-(3-methoxyphenyl)-2-(1-methylpyrazol-4-yl)ethyl]hydrazine
CID 105191715

Frequently Asked Questions

What is the IUPAC name of [2-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine (CID 105205136) is [2-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine is COc1cccc(CC(NN)c2ccnn2C)c1.
What is the InChIKey of [2-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine?
The InChIKey is XJPPQELDEPMVIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c1-17-13(6-7-15-17)12(16-14)9-10-4-3-5-11(8-10)18-2/h3-8,12,16H,9,14H2,1-2H3.
What are the key properties of [2-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine?
[2-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine has a molecular weight of 246.31 g/mol, XLogP of 1.18, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105205136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).