[(2,4-dimethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine

C13H20N2O3 — CID 105229519

IUPAC[(2,4-dimethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine
SMILESCOc1ccc(C(NN)C2CCOC2)c(OC)c1
InChIInChI=1S/C13H20N2O3/c1-16-10-3-4-11(12(7-10)17-2)13(15-14)9-5-6-18-8-9/h3-4,7,9,13,15H,5-6,8,14H2,1-2H3
InChIKeyVUFQCIXCDVWFIL-UHFFFAOYSA-N
MW252.31 g/mol
LogP1.24
Rot. Bonds5

About [(2,4-dimethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine

[(2,4-dimethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine (PubChem CID 105229519) has the molecular formula C13H20N2O3 and a molecular weight of 252.31 g/mol. Its IUPAC name is [(2,4-dimethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,4-dimethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine
PubChem CID105229519
Molecular FormulaC13H20N2O3
Molecular Weight252.31 g/mol
Exact Mass252.15
IUPAC Name[(2,4-dimethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine
SMILESCOc1ccc(C(NN)C2CCOC2)c(OC)c1
InChIInChI=1S/C13H20N2O3/c1-16-10-3-4-11(12(7-10)17-2)13(15-14)9-5-6-18-8-9/h3-4,7,9,13,15H,5-6,8,14H2,1-2H3
InChIKeyVUFQCIXCDVWFIL-UHFFFAOYSA-N
XLogP1.24
TPSA65.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 51.24
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

[(2-methoxy-4-methylphenyl)-(oxolan-3-yl)methyl]hydrazine
CID 106793716
[(2,4-dimethoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine
CID 105210736
[(2,4-dimethoxyphenyl)-(4,4-dimethylcyclohexyl)methyl]hydrazine
CID 105231871
(2,4-dimethoxyphenyl)-(oxan-4-yl)methanamine
CID 62905650
[(2,4-dimethoxyphenyl)-(4-ethylcyclohexyl)methyl]hydrazine
CID 105231570
(R)-(2,4-dimethoxyphenyl)-(oxan-4-yl)methanamine;hydrochloride
CID 171246686
1-(2-bromo-4-methoxyphenyl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 61276590
[(2,4-dimethylphenyl)-(oxolan-3-yl)methyl]hydrazine
CID 105229339
3-[chloro-(2,4-dimethoxyphenyl)methyl]oxane
CID 55149395
N-[(4-methoxy-2-methylphenyl)-(oxolan-3-yl)methyl]ethanamine
CID 61276557
1-(2,4-dimethoxyphenyl)-N-methyl-2-(oxan-4-yl)ethanamine
CID 115846581
[(2-bromo-5-methylphenyl)-(oxolan-3-yl)methyl]hydrazine
CID 105306637

Frequently Asked Questions

What is the IUPAC name of [(2,4-dimethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine?
The IUPAC name of [(2,4-dimethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine (CID 105229519) is [(2,4-dimethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine.
What is the SMILES notation for [(2,4-dimethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine?
The canonical SMILES for [(2,4-dimethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine is COc1ccc(C(NN)C2CCOC2)c(OC)c1.
What is the InChIKey of [(2,4-dimethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine?
The InChIKey is VUFQCIXCDVWFIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3/c1-16-10-3-4-11(12(7-10)17-2)13(15-14)9-5-6-18-8-9/h3-4,7,9,13,15H,5-6,8,14H2,1-2H3.
What are the key properties of [(2,4-dimethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine?
[(2,4-dimethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine has a molecular weight of 252.31 g/mol, XLogP of 1.24, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,4-dimethoxyphenyl)-(oxolan-3-yl)methyl]hydrazine is sourced from PubChem (CID 105229519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).