[1-(furan-3-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine

C13H20N4O — CID 105305907

IUPAC[1-(furan-3-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
SMILESCc1nn(C)c(C)c1CCC(NN)c1ccoc1
InChIInChI=1S/C13H20N4O/c1-9-12(10(2)17(3)16-9)4-5-13(15-14)11-6-7-18-8-11/h6-8,13,15H,4-5,14H2,1-3H3
InChIKeyHCYXFURYUSXODH-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.77
Rot. Bonds5

About [1-(furan-3-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine

[1-(furan-3-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine (PubChem CID 105305907) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is [1-(furan-3-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine.

Molecular Properties

Compound Name[1-(furan-3-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
PubChem CID105305907
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name[1-(furan-3-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
SMILESCc1nn(C)c(C)c1CCC(NN)c1ccoc1
InChIInChI=1S/C13H20N4O/c1-9-12(10(2)17(3)16-9)4-5-13(15-14)11-6-7-18-8-11/h6-8,13,15H,4-5,14H2,1-3H3
InChIKeyHCYXFURYUSXODH-UHFFFAOYSA-N
XLogP1.77
TPSA69.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.77
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

[1-pyridin-3-yl-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105287115
[1-(4-fluoro-3-methylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105302658
[1-(3-methoxyphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105283653
[1-(5-fluoro-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105288178
[1-(1-propylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105288593
[1-(2-fluorophenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105292407
[1-(2,3-dihydrofuran-5-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 102654606
[1-(2,3-dichlorophenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105301729
[1-pyrazin-2-yl-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105308736
[1-(4-methoxy-1-methylpyrazol-5-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105339139
[1-(3-methoxypyrazin-2-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105332696
[1-(furan-3-yl)-3-phenylpropyl]hydrazine
CID 105205786

Frequently Asked Questions

What is the IUPAC name of [1-(furan-3-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine?
The IUPAC name of [1-(furan-3-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine (CID 105305907) is [1-(furan-3-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine.
What is the SMILES notation for [1-(furan-3-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine?
The canonical SMILES for [1-(furan-3-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine is Cc1nn(C)c(C)c1CCC(NN)c1ccoc1.
What is the InChIKey of [1-(furan-3-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine?
The InChIKey is HCYXFURYUSXODH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-9-12(10(2)17(3)16-9)4-5-13(15-14)11-6-7-18-8-11/h6-8,13,15H,4-5,14H2,1-3H3.
What are the key properties of [1-(furan-3-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine?
[1-(furan-3-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine has a molecular weight of 248.33 g/mol, XLogP of 1.77, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(furan-3-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine is sourced from PubChem (CID 105305907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).