[oxan-4-yl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine

C12H22N4O — CID 105306209

IUPAC[oxan-4-yl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine
SMILESCc1nn(C)c(C)c1C(NN)C1CCOCC1
InChIInChI=1S/C12H22N4O/c1-8-11(9(2)16(3)15-8)12(14-13)10-4-6-17-7-5-10/h10,12,14H,4-7,13H2,1-3H3
InChIKeyDYYILLMIMMCPEP-UHFFFAOYSA-N
MW238.33 g/mol
LogP0.97
Rot. Bonds3

About [oxan-4-yl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine

[oxan-4-yl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine (PubChem CID 105306209) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is [oxan-4-yl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[oxan-4-yl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine
PubChem CID105306209
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Name[oxan-4-yl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine
SMILESCc1nn(C)c(C)c1C(NN)C1CCOCC1
InChIInChI=1S/C12H22N4O/c1-8-11(9(2)16(3)15-8)12(14-13)10-4-6-17-7-5-10/h10,12,14H,4-7,13H2,1-3H3
InChIKeyDYYILLMIMMCPEP-UHFFFAOYSA-N
XLogP0.97
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 50.97
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

[cyclobutyl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine
CID 105340101
[(4-methylcyclohexyl)-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine
CID 105311803
N-[oxolan-3-yl-(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine
CID 105147577
[1-(oxolan-3-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine
CID 105306650
N-[cyclopropyl-(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine
CID 105157191
[(1-methylindazol-3-yl)-(oxan-4-yl)methyl]hydrazine
CID 103129649
[(1,5-dimethylpyrazol-4-yl)-(oxolan-3-yl)methyl]hydrazine
CID 105306569
[3-(oxolan-2-yl)-1-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105314270
cyclopropyl-(1,3,5-trimethylpyrazol-4-yl)methanol
CID 105105459
N-methyl-1-(oxan-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-amine
CID 105138618
[(2-fluoro-4,6-dimethylphenyl)-(oxan-4-yl)methyl]hydrazine
CID 106884320
[(5-methylfuran-2-yl)-(oxan-4-yl)methyl]hydrazine
CID 105306266

Frequently Asked Questions

What is the IUPAC name of [oxan-4-yl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine?
The IUPAC name of [oxan-4-yl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine (CID 105306209) is [oxan-4-yl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [oxan-4-yl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine?
The canonical SMILES for [oxan-4-yl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine is Cc1nn(C)c(C)c1C(NN)C1CCOCC1.
What is the InChIKey of [oxan-4-yl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine?
The InChIKey is DYYILLMIMMCPEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-8-11(9(2)16(3)15-8)12(14-13)10-4-6-17-7-5-10/h10,12,14H,4-7,13H2,1-3H3.
What are the key properties of [oxan-4-yl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine?
[oxan-4-yl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine has a molecular weight of 238.33 g/mol, XLogP of 0.97, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [oxan-4-yl-(1,3,5-trimethylpyrazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 105306209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).