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

C12H15IN2O — CID 105333272

IUPAC[3,4-dihydro-2H-pyran-5-yl-(4-iodophenyl)methyl]hydrazine
SMILESNNC(C1=COCCC1)c1ccc(I)cc1
InChIInChI=1S/C12H15IN2O/c13-11-5-3-9(4-6-11)12(15-14)10-2-1-7-16-8-10/h3-6,8,12,15H,1-2,7,14H2
InChIKeyDEHFSFPJMIMFFQ-UHFFFAOYSA-N
MW330.17 g/mol
LogP2.49
Rot. Bonds3

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

[3,4-dihydro-2H-pyran-5-yl-(4-iodophenyl)methyl]hydrazine (PubChem CID 105333272) has the molecular formula C12H15IN2O and a molecular weight of 330.17 g/mol. Its IUPAC name is [3,4-dihydro-2H-pyran-5-yl-(4-iodophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[3,4-dihydro-2H-pyran-5-yl-(4-iodophenyl)methyl]hydrazine
PubChem CID105333272
Molecular FormulaC12H15IN2O
Molecular Weight330.17 g/mol
Exact Mass330.02
IUPAC Name[3,4-dihydro-2H-pyran-5-yl-(4-iodophenyl)methyl]hydrazine
SMILESNNC(C1=COCCC1)c1ccc(I)cc1
InChIInChI=1S/C12H15IN2O/c13-11-5-3-9(4-6-11)12(15-14)10-2-1-7-16-8-10/h3-6,8,12,15H,1-2,7,14H2
InChIKeyDEHFSFPJMIMFFQ-UHFFFAOYSA-N
XLogP2.49
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.17
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(3-chloro-4-methylphenyl)-(3,4-dihydro-2H-pyran-5-yl)methyl]hydrazine
CID 105333182
[3,4-dihydro-2H-pyran-5-yl-(3,4,5-trifluorophenyl)methyl]hydrazine
CID 105208035
[(2-chlorophenyl)-(3,4-dihydro-2H-pyran-5-yl)methyl]hydrazine
CID 105210973
[3,4-dihydro-2H-pyran-5-yl-(3-fluoro-4-methoxyphenyl)methyl]hydrazine
CID 105333247
[(3-bromo-5-chlorophenyl)-(3,4-dihydro-2H-pyran-5-yl)methyl]hydrazine
CID 107948477
[3,4-dihydro-2H-pyran-5-yl-(2-methylsulfanylphenyl)methyl]hydrazine
CID 105333174
[3,4-dihydro-2H-pyran-5-yl-(6-methoxypyridazin-3-yl)methyl]hydrazine
CID 103375762
[(5-bromo-2-pyridinyl)-(3,4-dihydro-2H-pyran-5-yl)methyl]hydrazine
CID 105267637
[3,4-dihydro-2H-pyran-5-yl-(2,5-dimethylpyrazol-3-yl)methyl]hydrazine
CID 105333213
[3,4-dihydro-2H-pyran-5-yl-(4-methylthiophen-3-yl)methyl]hydrazine
CID 105251691
[2,3-dihydro-1H-inden-5-yl-(4-iodophenyl)methyl]hydrazine
CID 114195243
[1-(3,4-dihydro-2H-pyran-5-yl)-2-methylsulfanylethyl]hydrazine
CID 105213767

Frequently Asked Questions

What is the IUPAC name of [3,4-dihydro-2H-pyran-5-yl-(4-iodophenyl)methyl]hydrazine?
The IUPAC name of [3,4-dihydro-2H-pyran-5-yl-(4-iodophenyl)methyl]hydrazine (CID 105333272) is [3,4-dihydro-2H-pyran-5-yl-(4-iodophenyl)methyl]hydrazine.
What is the SMILES notation for [3,4-dihydro-2H-pyran-5-yl-(4-iodophenyl)methyl]hydrazine?
The canonical SMILES for [3,4-dihydro-2H-pyran-5-yl-(4-iodophenyl)methyl]hydrazine is NNC(C1=COCCC1)c1ccc(I)cc1.
What is the InChIKey of [3,4-dihydro-2H-pyran-5-yl-(4-iodophenyl)methyl]hydrazine?
The InChIKey is DEHFSFPJMIMFFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15IN2O/c13-11-5-3-9(4-6-11)12(15-14)10-2-1-7-16-8-10/h3-6,8,12,15H,1-2,7,14H2.
What are the key properties of [3,4-dihydro-2H-pyran-5-yl-(4-iodophenyl)methyl]hydrazine?
[3,4-dihydro-2H-pyran-5-yl-(4-iodophenyl)methyl]hydrazine has a molecular weight of 330.17 g/mol, XLogP of 2.49, 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-(4-iodophenyl)methyl]hydrazine is sourced from PubChem (CID 105333272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).