[3,4-dihydro-2H-pyran-6-yl-(3-ethyl-1-methylpyrazol-4-yl)methyl]hydrazine

C12H20N4O — CID 102813272

IUPAC[3,4-dihydro-2H-pyran-6-yl-(3-ethyl-1-methylpyrazol-4-yl)methyl]hydrazine
SMILESCCc1nn(C)cc1C(NN)C1=CCCCO1
InChIInChI=1S/C12H20N4O/c1-3-10-9(8-16(2)15-10)12(14-13)11-6-4-5-7-17-11/h6,8,12,14H,3-5,7,13H2,1-2H3
InChIKeyMVFTZQIAFUURBZ-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.18
Rot. Bonds4

About [3,4-dihydro-2H-pyran-6-yl-(3-ethyl-1-methylpyrazol-4-yl)methyl]hydrazine

[3,4-dihydro-2H-pyran-6-yl-(3-ethyl-1-methylpyrazol-4-yl)methyl]hydrazine (PubChem CID 102813272) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is [3,4-dihydro-2H-pyran-6-yl-(3-ethyl-1-methylpyrazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[3,4-dihydro-2H-pyran-6-yl-(3-ethyl-1-methylpyrazol-4-yl)methyl]hydrazine
PubChem CID102813272
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name[3,4-dihydro-2H-pyran-6-yl-(3-ethyl-1-methylpyrazol-4-yl)methyl]hydrazine
SMILESCCc1nn(C)cc1C(NN)C1=CCCCO1
InChIInChI=1S/C12H20N4O/c1-3-10-9(8-16(2)15-10)12(14-13)11-6-4-5-7-17-11/h6,8,12,14H,3-5,7,13H2,1-2H3
InChIKeyMVFTZQIAFUURBZ-UHFFFAOYSA-N
XLogP1.18
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.18
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 [3,4-dihydro-2H-pyran-6-yl-(3-ethyl-1-methylpyrazol-4-yl)methyl]hydrazine?
The IUPAC name of [3,4-dihydro-2H-pyran-6-yl-(3-ethyl-1-methylpyrazol-4-yl)methyl]hydrazine (CID 102813272) is [3,4-dihydro-2H-pyran-6-yl-(3-ethyl-1-methylpyrazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [3,4-dihydro-2H-pyran-6-yl-(3-ethyl-1-methylpyrazol-4-yl)methyl]hydrazine?
The canonical SMILES for [3,4-dihydro-2H-pyran-6-yl-(3-ethyl-1-methylpyrazol-4-yl)methyl]hydrazine is CCc1nn(C)cc1C(NN)C1=CCCCO1.
What is the InChIKey of [3,4-dihydro-2H-pyran-6-yl-(3-ethyl-1-methylpyrazol-4-yl)methyl]hydrazine?
The InChIKey is MVFTZQIAFUURBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-3-10-9(8-16(2)15-10)12(14-13)11-6-4-5-7-17-11/h6,8,12,14H,3-5,7,13H2,1-2H3.
What are the key properties of [3,4-dihydro-2H-pyran-6-yl-(3-ethyl-1-methylpyrazol-4-yl)methyl]hydrazine?
[3,4-dihydro-2H-pyran-6-yl-(3-ethyl-1-methylpyrazol-4-yl)methyl]hydrazine has a molecular weight of 236.32 g/mol, XLogP of 1.18, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3,4-dihydro-2H-pyran-6-yl-(3-ethyl-1-methylpyrazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 102813272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).