[3-methyl-1-(1-phenylpyrazol-4-yl)hexyl]hydrazine

C16H24N4 — CID 105298119

IUPAC[3-methyl-1-(1-phenylpyrazol-4-yl)hexyl]hydrazine
SMILESCCCC(C)CC(NN)c1cnn(-c2ccccc2)c1
InChIInChI=1S/C16H24N4/c1-3-7-13(2)10-16(19-17)14-11-18-20(12-14)15-8-5-4-6-9-15/h4-6,8-9,11-13,16,19H,3,7,10,17H2,1-2H3
InChIKeyQOOVYIZVTXTHLP-UHFFFAOYSA-N
MW272.40 g/mol
LogP3.20
Rot. Bonds7

About [3-methyl-1-(1-phenylpyrazol-4-yl)hexyl]hydrazine

[3-methyl-1-(1-phenylpyrazol-4-yl)hexyl]hydrazine (PubChem CID 105298119) has the molecular formula C16H24N4 and a molecular weight of 272.40 g/mol. Its IUPAC name is [3-methyl-1-(1-phenylpyrazol-4-yl)hexyl]hydrazine.

Molecular Properties

Compound Name[3-methyl-1-(1-phenylpyrazol-4-yl)hexyl]hydrazine
PubChem CID105298119
Molecular FormulaC16H24N4
Molecular Weight272.40 g/mol
Exact Mass272.20
IUPAC Name[3-methyl-1-(1-phenylpyrazol-4-yl)hexyl]hydrazine
SMILESCCCC(C)CC(NN)c1cnn(-c2ccccc2)c1
InChIInChI=1S/C16H24N4/c1-3-7-13(2)10-16(19-17)14-11-18-20(12-14)15-8-5-4-6-9-15/h4-6,8-9,11-13,16,19H,3,7,10,17H2,1-2H3
InChIKeyQOOVYIZVTXTHLP-UHFFFAOYSA-N
XLogP3.20
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.40
LogP ≤ 53.20
H-Bond Donors ≤ 52
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

[1-(1-phenylpyrazol-4-yl)-2-propan-2-yloxyethyl]hydrazine
CID 105323696
1-(1-phenylpyrazol-4-yl)ethylhydrazine
CID 81470645
[3-methylidene-1-(1-phenylpyrazol-4-yl)pentyl]hydrazine
CID 105320295
[2-(1-methylimidazol-2-yl)-1-(1-phenylpyrazol-4-yl)ethyl]hydrazine
CID 105322893
[2-(1-methylpyrazol-3-yl)-1-(1-phenylpyrazol-4-yl)ethyl]hydrazine
CID 105329489
N-[1-(1-phenylpyrazol-4-yl)ethyl]hex-1-yn-3-amine
CID 106227178
1-(1-phenylpyrazol-4-yl)-N-propylpent-3-yn-1-amine
CID 105112397
3,3-dimethyl-1-(1-phenylpyrazol-4-yl)-N-propylbutan-1-amine
CID 43497373
N-ethyl-2-methoxy-1-(1-phenylpyrazol-4-yl)ethanamine
CID 105165630
[1-(furan-3-yl)-3-methylhexyl]hydrazine
CID 105221314
4-(1-chloro-3-methylbutyl)-1-phenylpyrazole
CID 61085631
2-cyclobutyl-N-ethyl-1-(1-phenylpyrazol-4-yl)ethanamine
CID 105151678

Frequently Asked Questions

What is the IUPAC name of [3-methyl-1-(1-phenylpyrazol-4-yl)hexyl]hydrazine?
The IUPAC name of [3-methyl-1-(1-phenylpyrazol-4-yl)hexyl]hydrazine (CID 105298119) is [3-methyl-1-(1-phenylpyrazol-4-yl)hexyl]hydrazine.
What is the SMILES notation for [3-methyl-1-(1-phenylpyrazol-4-yl)hexyl]hydrazine?
The canonical SMILES for [3-methyl-1-(1-phenylpyrazol-4-yl)hexyl]hydrazine is CCCC(C)CC(NN)c1cnn(-c2ccccc2)c1.
What is the InChIKey of [3-methyl-1-(1-phenylpyrazol-4-yl)hexyl]hydrazine?
The InChIKey is QOOVYIZVTXTHLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4/c1-3-7-13(2)10-16(19-17)14-11-18-20(12-14)15-8-5-4-6-9-15/h4-6,8-9,11-13,16,19H,3,7,10,17H2,1-2H3.
What are the key properties of [3-methyl-1-(1-phenylpyrazol-4-yl)hexyl]hydrazine?
[3-methyl-1-(1-phenylpyrazol-4-yl)hexyl]hydrazine has a molecular weight of 272.40 g/mol, XLogP of 3.20, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methyl-1-(1-phenylpyrazol-4-yl)hexyl]hydrazine is sourced from PubChem (CID 105298119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).