[4-ethoxy-4-ethyl-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine

C14H28N4O — CID 103027107

IUPAC[4-ethoxy-4-ethyl-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine
SMILESCCOC(CC)(CC)C(CCc1cnn(C)c1)NN
InChIInChI=1S/C14H28N4O/c1-5-14(6-2,19-7-3)13(17-15)9-8-12-10-16-18(4)11-12/h10-11,13,17H,5-9,15H2,1-4H3
InChIKeyAMHQRRUFLXYONJ-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.78
Rot. Bonds9

About [4-ethoxy-4-ethyl-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine

[4-ethoxy-4-ethyl-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine (PubChem CID 103027107) has the molecular formula C14H28N4O and a molecular weight of 268.40 g/mol. Its IUPAC name is [4-ethoxy-4-ethyl-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine.

Molecular Properties

Compound Name[4-ethoxy-4-ethyl-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine
PubChem CID103027107
Molecular FormulaC14H28N4O
Molecular Weight268.40 g/mol
Exact Mass268.23
IUPAC Name[4-ethoxy-4-ethyl-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine
SMILESCCOC(CC)(CC)C(CCc1cnn(C)c1)NN
InChIInChI=1S/C14H28N4O/c1-5-14(6-2,19-7-3)13(17-15)9-8-12-10-16-18(4)11-12/h10-11,13,17H,5-9,15H2,1-4H3
InChIKeyAMHQRRUFLXYONJ-UHFFFAOYSA-N
XLogP1.78
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

4-ethoxy-4-methyl-1-(1-methylpyrazol-4-yl)-N-propylhexan-3-amine
CID 103012413
4-methoxy-4-methyl-1-(1-methylpyrazol-4-yl)hexan-3-amine
CID 103012385
[1-(3,5-difluorophenyl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine
CID 103025740
[4-(1-methylpyrazol-4-yl)-1-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
CID 103217867
[1-cycloheptyl-3-(1-methylpyrazol-4-yl)propyl]hydrazine
CID 103025788
1-(1-methylpyrazol-4-yl)undecan-3-ylhydrazine
CID 103025813
[1-(3-bicyclo[3.1.0]hexanyl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine
CID 103025847
[1-(4-methoxythiophen-2-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine
CID 103025585
ethyl 2-amino-4-(1-methylpyrazol-4-yl)butanoate
CID 103002910
4-ethoxy-1-(1-methylpyrazol-4-yl)pentan-3-ol
CID 103008145
1-(1-methylpyrazol-4-yl)hex-5-en-3-ylhydrazine
CID 103027060
[1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylpyrazol-4-yl)propyl]hydrazine
CID 103025805

Frequently Asked Questions

What is the IUPAC name of [4-ethoxy-4-ethyl-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine?
The IUPAC name of [4-ethoxy-4-ethyl-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine (CID 103027107) is [4-ethoxy-4-ethyl-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine.
What is the SMILES notation for [4-ethoxy-4-ethyl-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine?
The canonical SMILES for [4-ethoxy-4-ethyl-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine is CCOC(CC)(CC)C(CCc1cnn(C)c1)NN.
What is the InChIKey of [4-ethoxy-4-ethyl-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine?
The InChIKey is AMHQRRUFLXYONJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4O/c1-5-14(6-2,19-7-3)13(17-15)9-8-12-10-16-18(4)11-12/h10-11,13,17H,5-9,15H2,1-4H3.
What are the key properties of [4-ethoxy-4-ethyl-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine?
[4-ethoxy-4-ethyl-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine has a molecular weight of 268.40 g/mol, XLogP of 1.78, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-ethoxy-4-ethyl-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine is sourced from PubChem (CID 103027107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).