[(3,4-diethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine

C15H24N2O3 — CID 105229485

IUPAC[(3,4-diethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine
SMILESCCOc1ccc(C(NN)C2CCOC2)cc1OCC
InChIInChI=1S/C15H24N2O3/c1-3-19-13-6-5-11(9-14(13)20-4-2)15(17-16)12-7-8-18-10-12/h5-6,9,12,15,17H,3-4,7-8,10,16H2,1-2H3
InChIKeyXNZMWXMMSFUOAH-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.02
Rot. Bonds7

About [(3,4-diethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine

[(3,4-diethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine (PubChem CID 105229485) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is [(3,4-diethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,4-diethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine
PubChem CID105229485
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name[(3,4-diethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine
SMILESCCOc1ccc(C(NN)C2CCOC2)cc1OCC
InChIInChI=1S/C15H24N2O3/c1-3-19-13-6-5-11(9-14(13)20-4-2)15(17-16)12-7-8-18-10-12/h5-6,9,12,15,17H,3-4,7-8,10,16H2,1-2H3
InChIKeyXNZMWXMMSFUOAH-UHFFFAOYSA-N
XLogP2.02
TPSA65.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.02
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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Related Compounds

N-[(3-bromo-4-ethoxyphenyl)-(oxolan-3-yl)methyl]ethanamine
CID 104657640
(3,4-diethoxyphenyl)-(oxan-4-yl)methanol
CID 62905165
[2,3-dihydro-1,4-benzodioxin-6-yl(oxolan-3-yl)methyl]hydrazine
CID 105229478
[(4-tert-butylphenyl)-(oxolan-3-yl)methyl]hydrazine
CID 105229515
(S)-(4-ethoxy-3-methoxyphenyl)-(oxan-4-yl)methanamine;hydrochloride
CID 171243693
2-cyclobutyl-1-(3,4-diethoxyphenyl)-N-methylethanamine
CID 115863730
[(2-methoxy-4-methylphenyl)-(oxolan-3-yl)methyl]hydrazine
CID 106793716
[(2,4-dimethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine
CID 105229519
N-[(3-methoxy-4-methylphenyl)-(oxolan-3-yl)methyl]propan-1-amine
CID 115856489
2-cyclopentyl-2-(3,4-diethoxyphenyl)ethanamine
CID 83973829
[(2,4-dimethylphenyl)-(oxolan-3-yl)methyl]hydrazine
CID 105229339
2-cyclopropyl-1-(3,4-diethoxyphenyl)propan-1-amine
CID 83154180

Frequently Asked Questions

What is the IUPAC name of [(3,4-diethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine?
The IUPAC name of [(3,4-diethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine (CID 105229485) is [(3,4-diethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine.
What is the SMILES notation for [(3,4-diethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine?
The canonical SMILES for [(3,4-diethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine is CCOc1ccc(C(NN)C2CCOC2)cc1OCC.
What is the InChIKey of [(3,4-diethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine?
The InChIKey is XNZMWXMMSFUOAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-3-19-13-6-5-11(9-14(13)20-4-2)15(17-16)12-7-8-18-10-12/h5-6,9,12,15,17H,3-4,7-8,10,16H2,1-2H3.
What are the key properties of [(3,4-diethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine?
[(3,4-diethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine has a molecular weight of 280.37 g/mol, XLogP of 2.02, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,4-diethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine is sourced from PubChem (CID 105229485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).