[2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine

C12H22N4O — CID 103170830

IUPAC[2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine
SMILESCCn1ncc(OC)c1C(CC1CCC1)NN
InChIInChI=1S/C12H22N4O/c1-3-16-12(11(17-2)8-14-16)10(15-13)7-9-5-4-6-9/h8-10,15H,3-7,13H2,1-2H3
InChIKeyWWTIYJJRNFNXPM-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.61
Rot. Bonds6

About [2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine

[2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine (PubChem CID 103170830) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is [2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine
PubChem CID103170830
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Name[2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine
SMILESCCn1ncc(OC)c1C(CC1CCC1)NN
InChIInChI=1S/C12H22N4O/c1-3-16-12(11(17-2)8-14-16)10(15-13)7-9-5-4-6-9/h8-10,15H,3-7,13H2,1-2H3
InChIKeyWWTIYJJRNFNXPM-UHFFFAOYSA-N
XLogP1.61
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.61
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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Frequently Asked Questions

What is the IUPAC name of [2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine?
The IUPAC name of [2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine (CID 103170830) is [2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine.
What is the SMILES notation for [2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine?
The canonical SMILES for [2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine is CCn1ncc(OC)c1C(CC1CCC1)NN.
What is the InChIKey of [2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine?
The InChIKey is WWTIYJJRNFNXPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-3-16-12(11(17-2)8-14-16)10(15-13)7-9-5-4-6-9/h8-10,15H,3-7,13H2,1-2H3.
What are the key properties of [2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine?
[2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine has a molecular weight of 238.33 g/mol, XLogP of 1.61, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclobutyl-1-(1-ethyl-4-methoxypyrazol-5-yl)ethyl]hydrazine is sourced from PubChem (CID 103170830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).