1-(1-phenylpyrazol-3-yl)oct-7-enylhydrazine

C17H24N4 — CID 107013000

IUPAC1-(1-phenylpyrazol-3-yl)oct-7-enylhydrazine
SMILESC=CCCCCCC(NN)c1ccn(-c2ccccc2)n1
InChIInChI=1S/C17H24N4/c1-2-3-4-5-9-12-16(19-18)17-13-14-21(20-17)15-10-7-6-8-11-15/h2,6-8,10-11,13-14,16,19H,1,3-5,9,12,18H2
InChIKeyJPUNNLWZWNQMLA-UHFFFAOYSA-N
MW284.41 g/mol
LogP3.51
Rot. Bonds9

About 1-(1-phenylpyrazol-3-yl)oct-7-enylhydrazine

1-(1-phenylpyrazol-3-yl)oct-7-enylhydrazine (PubChem CID 107013000) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is 1-(1-phenylpyrazol-3-yl)oct-7-enylhydrazine.

Molecular Properties

Compound Name1-(1-phenylpyrazol-3-yl)oct-7-enylhydrazine
PubChem CID107013000
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC Name1-(1-phenylpyrazol-3-yl)oct-7-enylhydrazine
SMILESC=CCCCCCC(NN)c1ccn(-c2ccccc2)n1
InChIInChI=1S/C17H24N4/c1-2-3-4-5-9-12-16(19-18)17-13-14-21(20-17)15-10-7-6-8-11-15/h2,6-8,10-11,13-14,16,19H,1,3-5,9,12,18H2
InChIKeyJPUNNLWZWNQMLA-UHFFFAOYSA-N
XLogP3.51
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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

[4,4,4-trifluoro-1-(1-phenylpyrazol-3-yl)butyl]hydrazine
CID 105313886
N-methyl-1-(1-phenylpyrazol-3-yl)octan-1-amine
CID 105124562
N-ethyl-1-(1-phenylpyrazol-3-yl)but-3-en-1-amine
CID 105108672
N-methyl-1-(1-methylpyrazol-3-yl)oct-7-en-1-amine
CID 107009195
[1-(1-phenylpyrazol-3-yl)-2-(1,3-thiazol-2-yl)ethyl]hydrazine
CID 105324589
1-thiophen-2-yloct-7-enylhydrazine
CID 107012375
[2-(1-methyltriazol-4-yl)-1-(1-phenylpyrazol-3-yl)ethyl]hydrazine
CID 107066649
1-(2-methyl-1,3-thiazol-4-yl)oct-7-enylhydrazine
CID 107012859
1-quinolin-4-yloct-7-enylhydrazine
CID 107013009
[3-methyl-1-(1-phenylpyrazol-3-yl)but-2-enyl]hydrazine
CID 105319814
1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine
CID 107012984
4-methoxy-1-(1-phenylpyrazol-3-yl)-N-propylbutan-1-amine
CID 105190345

Frequently Asked Questions

What is the IUPAC name of 1-(1-phenylpyrazol-3-yl)oct-7-enylhydrazine?
The IUPAC name of 1-(1-phenylpyrazol-3-yl)oct-7-enylhydrazine (CID 107013000) is 1-(1-phenylpyrazol-3-yl)oct-7-enylhydrazine.
What is the SMILES notation for 1-(1-phenylpyrazol-3-yl)oct-7-enylhydrazine?
The canonical SMILES for 1-(1-phenylpyrazol-3-yl)oct-7-enylhydrazine is C=CCCCCCC(NN)c1ccn(-c2ccccc2)n1.
What is the InChIKey of 1-(1-phenylpyrazol-3-yl)oct-7-enylhydrazine?
The InChIKey is JPUNNLWZWNQMLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-2-3-4-5-9-12-16(19-18)17-13-14-21(20-17)15-10-7-6-8-11-15/h2,6-8,10-11,13-14,16,19H,1,3-5,9,12,18H2.
What are the key properties of 1-(1-phenylpyrazol-3-yl)oct-7-enylhydrazine?
1-(1-phenylpyrazol-3-yl)oct-7-enylhydrazine has a molecular weight of 284.41 g/mol, XLogP of 3.51, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-phenylpyrazol-3-yl)oct-7-enylhydrazine is sourced from PubChem (CID 107013000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).