[1-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbut-3-enyl]hydrazine

C11H20N4 — CID 102813154

IUPAC[1-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbut-3-enyl]hydrazine
SMILESC=C(C)CC(NN)c1cn(C)nc1CC
InChIInChI=1S/C11H20N4/c1-5-10-9(7-15(4)14-10)11(13-12)6-8(2)3/h7,11,13H,2,5-6,12H2,1,3-4H3
InChIKeyVLKNHYDSBFRSPK-UHFFFAOYSA-N
MW208.31 g/mol
LogP1.45
Rot. Bonds5

About [1-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbut-3-enyl]hydrazine

[1-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbut-3-enyl]hydrazine (PubChem CID 102813154) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is [1-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbut-3-enyl]hydrazine.

Molecular Properties

Compound Name[1-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbut-3-enyl]hydrazine
PubChem CID102813154
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name[1-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbut-3-enyl]hydrazine
SMILESC=C(C)CC(NN)c1cn(C)nc1CC
InChIInChI=1S/C11H20N4/c1-5-10-9(7-15(4)14-10)11(13-12)6-8(2)3/h7,11,13H,2,5-6,12H2,1,3-4H3
InChIKeyVLKNHYDSBFRSPK-UHFFFAOYSA-N
XLogP1.45
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

[1-(3-ethyl-1-methylpyrazol-4-yl)-2-methylprop-2-enyl]hydrazine
CID 102813156
1-(3-ethyl-1-methylpyrazol-4-yl)-N-(2-methylprop-2-enyl)ethane-1,2-diamine
CID 114616015
1-(3-ethyl-1-methylpyrazol-4-yl)decylhydrazine
CID 102813033
2-amino-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol
CID 130166119
(3S)-3-acetamido-3-(3-ethyl-1-methylpyrazol-4-yl)propanoic acid
CID 103955785
[1-(3-ethyl-1-methylpyrazol-4-yl)-2,2-dimethylpropyl]hydrazine
CID 102813091
[1-(3-ethyl-1-methylpyrazol-4-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine
CID 103026081
[2-(5-bromo-2-pyridinyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine
CID 102813227
[2-(1-butan-2-ylpyrazol-3-yl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine
CID 102813123
methyl 3-(3-ethyl-1-methylpyrazol-4-yl)-3-(methylamino)propanoate
CID 112671468
[2-(2-chloro-4-methylphenyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethyl]hydrazine
CID 106868302
2-(cyclopropylamino)-2-(3-ethyl-1-methylpyrazol-4-yl)ethanol
CID 112670719

Frequently Asked Questions

What is the IUPAC name of [1-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbut-3-enyl]hydrazine?
The IUPAC name of [1-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbut-3-enyl]hydrazine (CID 102813154) is [1-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbut-3-enyl]hydrazine.
What is the SMILES notation for [1-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbut-3-enyl]hydrazine?
The canonical SMILES for [1-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbut-3-enyl]hydrazine is C=C(C)CC(NN)c1cn(C)nc1CC.
What is the InChIKey of [1-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbut-3-enyl]hydrazine?
The InChIKey is VLKNHYDSBFRSPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-5-10-9(7-15(4)14-10)11(13-12)6-8(2)3/h7,11,13H,2,5-6,12H2,1,3-4H3.
What are the key properties of [1-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbut-3-enyl]hydrazine?
[1-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbut-3-enyl]hydrazine has a molecular weight of 208.31 g/mol, XLogP of 1.45, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-ethyl-1-methylpyrazol-4-yl)-3-methylbut-3-enyl]hydrazine is sourced from PubChem (CID 102813154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).