[2-(cyclohexen-1-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine

C13H22N4O — CID 105270067

IUPAC[2-(cyclohexen-1-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine
SMILESCOc1cnn(C)c1C(CC1=CCCCC1)NN
InChIInChI=1S/C13H22N4O/c1-17-13(12(18-2)9-15-17)11(16-14)8-10-6-4-3-5-7-10/h6,9,11,16H,3-5,7-8,14H2,1-2H3
InChIKeyLLYVLELSXPOLEH-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.82
Rot. Bonds5

About [2-(cyclohexen-1-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine

[2-(cyclohexen-1-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine (PubChem CID 105270067) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is [2-(cyclohexen-1-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(cyclohexen-1-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine
PubChem CID105270067
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name[2-(cyclohexen-1-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine
SMILESCOc1cnn(C)c1C(CC1=CCCCC1)NN
InChIInChI=1S/C13H22N4O/c1-17-13(12(18-2)9-15-17)11(16-14)8-10-6-4-3-5-7-10/h6,9,11,16H,3-5,7-8,14H2,1-2H3
InChIKeyLLYVLELSXPOLEH-UHFFFAOYSA-N
XLogP1.82
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[2-(cyclohexen-1-yl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)ethyl]hydrazine
CID 105270013
2-(cyclohexen-1-yl)-N-ethyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanamine
CID 114660885
[1-(4-methoxy-1-methylpyrazol-5-yl)-2-phenylethyl]hydrazine
CID 105195307
[2-ethoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine
CID 105235358
[2-(cyclohexen-1-yl)-1-(5-fluoro-2-methoxyphenyl)ethyl]hydrazine
CID 105270064
[2-(2-fluorophenyl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine
CID 105206986
[2-(cyclohexen-1-yl)-1-(5-methoxy-3-pyridinyl)ethyl]hydrazine
CID 105270168
[3-ethoxy-1-(4-methoxy-1-methylpyrazol-5-yl)propyl]hydrazine
CID 105339146
N-[1-(4-bromo-1-methylpyrazol-5-yl)-2-(cyclohexen-1-yl)ethyl]propan-1-amine
CID 114660904
N,N-diethyl-3-hydrazinyl-3-(4-methoxy-1-methylpyrazol-5-yl)propan-1-amine
CID 105244142
1-(4-methoxy-1-methylpyrazol-5-yl)ethylhydrazine
CID 105201324
3-cyclopentyl-N-ethyl-1-(4-methoxy-1-methylpyrazol-5-yl)propan-1-amine
CID 105047094

Frequently Asked Questions

What is the IUPAC name of [2-(cyclohexen-1-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine?
The IUPAC name of [2-(cyclohexen-1-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine (CID 105270067) is [2-(cyclohexen-1-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(cyclohexen-1-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine?
The canonical SMILES for [2-(cyclohexen-1-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine is COc1cnn(C)c1C(CC1=CCCCC1)NN.
What is the InChIKey of [2-(cyclohexen-1-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine?
The InChIKey is LLYVLELSXPOLEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-17-13(12(18-2)9-15-17)11(16-14)8-10-6-4-3-5-7-10/h6,9,11,16H,3-5,7-8,14H2,1-2H3.
What are the key properties of [2-(cyclohexen-1-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine?
[2-(cyclohexen-1-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine has a molecular weight of 250.35 g/mol, XLogP of 1.82, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclohexen-1-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethyl]hydrazine is sourced from PubChem (CID 105270067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).