1-(3-ethyl-1-methylpyrazol-5-yl)octylhydrazine

C14H28N4 — CID 105293484

IUPAC1-(3-ethyl-1-methylpyrazol-5-yl)octylhydrazine
SMILESCCCCCCCC(NN)c1cc(CC)nn1C
InChIInChI=1S/C14H28N4/c1-4-6-7-8-9-10-13(16-15)14-11-12(5-2)17-18(14)3/h11,13,16H,4-10,15H2,1-3H3
InChIKeyNIGQCPXKLNLNHT-UHFFFAOYSA-N
MW252.41 g/mol
LogP2.85
Rot. Bonds9

About 1-(3-ethyl-1-methylpyrazol-5-yl)octylhydrazine

1-(3-ethyl-1-methylpyrazol-5-yl)octylhydrazine (PubChem CID 105293484) has the molecular formula C14H28N4 and a molecular weight of 252.41 g/mol. Its IUPAC name is 1-(3-ethyl-1-methylpyrazol-5-yl)octylhydrazine.

Molecular Properties

Compound Name1-(3-ethyl-1-methylpyrazol-5-yl)octylhydrazine
PubChem CID105293484
Molecular FormulaC14H28N4
Molecular Weight252.41 g/mol
Exact Mass252.23
IUPAC Name1-(3-ethyl-1-methylpyrazol-5-yl)octylhydrazine
SMILESCCCCCCCC(NN)c1cc(CC)nn1C
InChIInChI=1S/C14H28N4/c1-4-6-7-8-9-10-13(16-15)14-11-12(5-2)17-18(14)3/h11,13,16H,4-10,15H2,1-3H3
InChIKeyNIGQCPXKLNLNHT-UHFFFAOYSA-N
XLogP2.85
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.41
LogP ≤ 52.85
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-(3-ethyl-1-methylpyrazol-5-yl)-N-methylnonan-1-amine
CID 105127778
1-(2,5-dimethylpyrazol-3-yl)octylhydrazine
CID 105293599
1-(3-ethyl-1-methylpyrazol-5-yl)decan-1-ol
CID 105084923
1-(3-ethyl-1-methylpyrazol-5-yl)undecan-1-amine
CID 105138150
1,2-bis(3-ethyl-1-methylpyrazol-5-yl)ethylhydrazine
CID 105317064
1-(3-methyltriazol-4-yl)dodecylhydrazine
CID 105337498
1-(3-methyltriazol-4-yl)hexylhydrazine
CID 105337497
[1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine
CID 103025805
1-(2-methylpyrazol-3-yl)dodecylhydrazine
CID 105307363
[2-(1,3-diethylpyrazol-5-yl)-1-(3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine
CID 105318310
1-(1,3-diethylpyrazol-5-yl)-N-ethylnonan-1-amine
CID 105127926
3-ethyl-1-(3-ethyl-1-methylpyrazol-5-yl)-N-methylheptan-1-amine
CID 105102750

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethyl-1-methylpyrazol-5-yl)octylhydrazine?
The IUPAC name of 1-(3-ethyl-1-methylpyrazol-5-yl)octylhydrazine (CID 105293484) is 1-(3-ethyl-1-methylpyrazol-5-yl)octylhydrazine.
What is the SMILES notation for 1-(3-ethyl-1-methylpyrazol-5-yl)octylhydrazine?
The canonical SMILES for 1-(3-ethyl-1-methylpyrazol-5-yl)octylhydrazine is CCCCCCCC(NN)c1cc(CC)nn1C.
What is the InChIKey of 1-(3-ethyl-1-methylpyrazol-5-yl)octylhydrazine?
The InChIKey is NIGQCPXKLNLNHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4/c1-4-6-7-8-9-10-13(16-15)14-11-12(5-2)17-18(14)3/h11,13,16H,4-10,15H2,1-3H3.
What are the key properties of 1-(3-ethyl-1-methylpyrazol-5-yl)octylhydrazine?
1-(3-ethyl-1-methylpyrazol-5-yl)octylhydrazine has a molecular weight of 252.41 g/mol, XLogP of 2.85, 9 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-5-yl)octylhydrazine is sourced from PubChem (CID 105293484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).