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

C11H22N2O — CID 102650409

IUPAC[1-(3,4-dihydro-2H-pyran-6-yl)-3-methylpentyl]hydrazine
SMILESCCC(C)CC(NN)C1=CCCCO1
InChIInChI=1S/C11H22N2O/c1-3-9(2)8-10(13-12)11-6-4-5-7-14-11/h6,9-10,13H,3-5,7-8,12H2,1-2H3
InChIKeyPAICQUBUTPJHOA-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.95
Rot. Bonds5

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

[1-(3,4-dihydro-2H-pyran-6-yl)-3-methylpentyl]hydrazine (PubChem CID 102650409) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is [1-(3,4-dihydro-2H-pyran-6-yl)-3-methylpentyl]hydrazine.

Molecular Properties

Compound Name[1-(3,4-dihydro-2H-pyran-6-yl)-3-methylpentyl]hydrazine
PubChem CID102650409
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name[1-(3,4-dihydro-2H-pyran-6-yl)-3-methylpentyl]hydrazine
SMILESCCC(C)CC(NN)C1=CCCCO1
InChIInChI=1S/C11H22N2O/c1-3-9(2)8-10(13-12)11-6-4-5-7-14-11/h6,9-10,13H,3-5,7-8,12H2,1-2H3
InChIKeyPAICQUBUTPJHOA-UHFFFAOYSA-N
XLogP1.95
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 [1-(3,4-dihydro-2H-pyran-6-yl)-3-methylpentyl]hydrazine?
The IUPAC name of [1-(3,4-dihydro-2H-pyran-6-yl)-3-methylpentyl]hydrazine (CID 102650409) is [1-(3,4-dihydro-2H-pyran-6-yl)-3-methylpentyl]hydrazine.
What is the SMILES notation for [1-(3,4-dihydro-2H-pyran-6-yl)-3-methylpentyl]hydrazine?
The canonical SMILES for [1-(3,4-dihydro-2H-pyran-6-yl)-3-methylpentyl]hydrazine is CCC(C)CC(NN)C1=CCCCO1.
What is the InChIKey of [1-(3,4-dihydro-2H-pyran-6-yl)-3-methylpentyl]hydrazine?
The InChIKey is PAICQUBUTPJHOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-3-9(2)8-10(13-12)11-6-4-5-7-14-11/h6,9-10,13H,3-5,7-8,12H2,1-2H3.
What are the key properties of [1-(3,4-dihydro-2H-pyran-6-yl)-3-methylpentyl]hydrazine?
[1-(3,4-dihydro-2H-pyran-6-yl)-3-methylpentyl]hydrazine has a molecular weight of 198.31 g/mol, XLogP of 1.95, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,4-dihydro-2H-pyran-6-yl)-3-methylpentyl]hydrazine is sourced from PubChem (CID 102650409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).