[3,4-dihydro-2H-pyran-5-yl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine

C16H22N2O — CID 105218796

IUPAC[3,4-dihydro-2H-pyran-5-yl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine
SMILESNNC(C1=COCCC1)C1CCCc2ccccc21
InChIInChI=1S/C16H22N2O/c17-18-16(13-7-4-10-19-11-13)15-9-3-6-12-5-1-2-8-14(12)15/h1-2,5,8,11,15-16,18H,3-4,6-7,9-10,17H2
InChIKeyBIUYJSDAJFGLHZ-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.63
Rot. Bonds3

About [3,4-dihydro-2H-pyran-5-yl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine

[3,4-dihydro-2H-pyran-5-yl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine (PubChem CID 105218796) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is [3,4-dihydro-2H-pyran-5-yl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine.

Molecular Properties

Compound Name[3,4-dihydro-2H-pyran-5-yl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine
PubChem CID105218796
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC Name[3,4-dihydro-2H-pyran-5-yl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine
SMILESNNC(C1=COCCC1)C1CCCc2ccccc21
InChIInChI=1S/C16H22N2O/c17-18-16(13-7-4-10-19-11-13)15-9-3-6-12-5-1-2-8-14(12)15/h1-2,5,8,11,15-16,18H,3-4,6-7,9-10,17H2
InChIKeyBIUYJSDAJFGLHZ-UHFFFAOYSA-N
XLogP2.63
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.63
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 [3,4-dihydro-2H-pyran-5-yl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine?
The IUPAC name of [3,4-dihydro-2H-pyran-5-yl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine (CID 105218796) is [3,4-dihydro-2H-pyran-5-yl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine.
What is the SMILES notation for [3,4-dihydro-2H-pyran-5-yl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine?
The canonical SMILES for [3,4-dihydro-2H-pyran-5-yl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine is NNC(C1=COCCC1)C1CCCc2ccccc21.
What is the InChIKey of [3,4-dihydro-2H-pyran-5-yl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine?
The InChIKey is BIUYJSDAJFGLHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c17-18-16(13-7-4-10-19-11-13)15-9-3-6-12-5-1-2-8-14(12)15/h1-2,5,8,11,15-16,18H,3-4,6-7,9-10,17H2.
What are the key properties of [3,4-dihydro-2H-pyran-5-yl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine?
[3,4-dihydro-2H-pyran-5-yl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine has a molecular weight of 258.36 g/mol, XLogP of 2.63, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3,4-dihydro-2H-pyran-5-yl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine is sourced from PubChem (CID 105218796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).