1-(3,4-dihydro-2H-pyran-6-yl)dodecylhydrazine

C17H34N2O — CID 102650254

IUPAC1-(3,4-dihydro-2H-pyran-6-yl)dodecylhydrazine
SMILESCCCCCCCCCCCC(NN)C1=CCCCO1
InChIInChI=1S/C17H34N2O/c1-2-3-4-5-6-7-8-9-10-13-16(19-18)17-14-11-12-15-20-17/h14,16,19H,2-13,15,18H2,1H3
InChIKeyIJHKVQHFAKBQQB-UHFFFAOYSA-N
MW282.47 g/mol
LogP4.43
Rot. Bonds12

About 1-(3,4-dihydro-2H-pyran-6-yl)dodecylhydrazine

1-(3,4-dihydro-2H-pyran-6-yl)dodecylhydrazine (PubChem CID 102650254) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-pyran-6-yl)dodecylhydrazine.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-pyran-6-yl)dodecylhydrazine
PubChem CID102650254
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name1-(3,4-dihydro-2H-pyran-6-yl)dodecylhydrazine
SMILESCCCCCCCCCCCC(NN)C1=CCCCO1
InChIInChI=1S/C17H34N2O/c1-2-3-4-5-6-7-8-9-10-13-16(19-18)17-14-11-12-15-20-17/h14,16,19H,2-13,15,18H2,1H3
InChIKeyIJHKVQHFAKBQQB-UHFFFAOYSA-N
XLogP4.43
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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)dodecylhydrazine?
The IUPAC name of 1-(3,4-dihydro-2H-pyran-6-yl)dodecylhydrazine (CID 102650254) is 1-(3,4-dihydro-2H-pyran-6-yl)dodecylhydrazine.
What is the SMILES notation for 1-(3,4-dihydro-2H-pyran-6-yl)dodecylhydrazine?
The canonical SMILES for 1-(3,4-dihydro-2H-pyran-6-yl)dodecylhydrazine is CCCCCCCCCCCC(NN)C1=CCCCO1.
What is the InChIKey of 1-(3,4-dihydro-2H-pyran-6-yl)dodecylhydrazine?
The InChIKey is IJHKVQHFAKBQQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-2-3-4-5-6-7-8-9-10-13-16(19-18)17-14-11-12-15-20-17/h14,16,19H,2-13,15,18H2,1H3.
What are the key properties of 1-(3,4-dihydro-2H-pyran-6-yl)dodecylhydrazine?
1-(3,4-dihydro-2H-pyran-6-yl)dodecylhydrazine has a molecular weight of 282.47 g/mol, XLogP of 4.43, 12 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)dodecylhydrazine is sourced from PubChem (CID 102650254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).