1-(4-chloro-1-propylpyrazol-5-yl)hexylhydrazine

C12H23ClN4 — CID 105337103

IUPAC1-(4-chloro-1-propylpyrazol-5-yl)hexylhydrazine
SMILESCCCCCC(NN)c1c(Cl)cnn1CCC
InChIInChI=1S/C12H23ClN4/c1-3-5-6-7-11(16-14)12-10(13)9-15-17(12)8-4-2/h9,11,16H,3-8,14H2,1-2H3
InChIKeyIVUUNBCEXGRQKA-UHFFFAOYSA-N
MW258.80 g/mol
LogP3.03
Rot. Bonds8

About 1-(4-chloro-1-propylpyrazol-5-yl)hexylhydrazine

1-(4-chloro-1-propylpyrazol-5-yl)hexylhydrazine (PubChem CID 105337103) has the molecular formula C12H23ClN4 and a molecular weight of 258.80 g/mol. Its IUPAC name is 1-(4-chloro-1-propylpyrazol-5-yl)hexylhydrazine.

Molecular Properties

Compound Name1-(4-chloro-1-propylpyrazol-5-yl)hexylhydrazine
PubChem CID105337103
Molecular FormulaC12H23ClN4
Molecular Weight258.80 g/mol
Exact Mass258.16
IUPAC Name1-(4-chloro-1-propylpyrazol-5-yl)hexylhydrazine
SMILESCCCCCC(NN)c1c(Cl)cnn1CCC
InChIInChI=1S/C12H23ClN4/c1-3-5-6-7-11(16-14)12-10(13)9-15-17(12)8-4-2/h9,11,16H,3-8,14H2,1-2H3
InChIKeyIVUUNBCEXGRQKA-UHFFFAOYSA-N
XLogP3.03
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.80
LogP ≤ 53.03
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': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[1-(4-chloro-1-propylpyrazol-5-yl)-4,4,4-trifluorobutyl]hydrazine
CID 105248932
1-(4-chloro-1-propylpyrazol-5-yl)decan-1-amine
CID 105042639
1-[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]butylhydrazine
CID 105202075
[1-(4-chloro-1-propylpyrazol-5-yl)-2-[(2-methylpropan-2-yl)oxy]ethyl]hydrazine
CID 105337258
[1-(4-chloro-1-propylpyrazol-5-yl)-2-(4-methylphenyl)ethyl]hydrazine
CID 105211289
1-(4-chloro-1-ethylpyrazol-5-yl)-N-ethylnonan-1-amine
CID 105040884
[1-(4-chloro-1-propylpyrazol-5-yl)-2-methylpentyl]hydrazine
CID 105337196
1-(4-chloro-1-ethylpyrazol-5-yl)-N-ethyloctan-1-amine
CID 105040888
1-[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-N-methylnonan-1-amine
CID 105054424
[4-chloro-1-(4-methoxy-1-propylpyrazol-5-yl)butyl]hydrazine
CID 105235649
1-[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-N-ethylheptan-1-amine
CID 105054478
1-(4-chloro-1-ethylpyrazol-5-yl)dodecan-1-ol
CID 115834843

Frequently Asked Questions

What is the IUPAC name of 1-(4-chloro-1-propylpyrazol-5-yl)hexylhydrazine?
The IUPAC name of 1-(4-chloro-1-propylpyrazol-5-yl)hexylhydrazine (CID 105337103) is 1-(4-chloro-1-propylpyrazol-5-yl)hexylhydrazine.
What is the SMILES notation for 1-(4-chloro-1-propylpyrazol-5-yl)hexylhydrazine?
The canonical SMILES for 1-(4-chloro-1-propylpyrazol-5-yl)hexylhydrazine is CCCCCC(NN)c1c(Cl)cnn1CCC.
What is the InChIKey of 1-(4-chloro-1-propylpyrazol-5-yl)hexylhydrazine?
The InChIKey is IVUUNBCEXGRQKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23ClN4/c1-3-5-6-7-11(16-14)12-10(13)9-15-17(12)8-4-2/h9,11,16H,3-8,14H2,1-2H3.
What are the key properties of 1-(4-chloro-1-propylpyrazol-5-yl)hexylhydrazine?
1-(4-chloro-1-propylpyrazol-5-yl)hexylhydrazine has a molecular weight of 258.80 g/mol, XLogP of 3.03, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chloro-1-propylpyrazol-5-yl)hexylhydrazine is sourced from PubChem (CID 105337103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).