[(2-methylphenyl)-(oxan-3-yl)methyl]hydrazine

C13H20N2O — CID 105229812

IUPAC[(2-methylphenyl)-(oxan-3-yl)methyl]hydrazine
SMILESCc1ccccc1C(NN)C1CCCOC1
InChIInChI=1S/C13H20N2O/c1-10-5-2-3-7-12(10)13(15-14)11-6-4-8-16-9-11/h2-3,5,7,11,13,15H,4,6,8-9,14H2,1H3
InChIKeyGYQKXEJWEAIXQU-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.93
Rot. Bonds3

About [(2-methylphenyl)-(oxan-3-yl)methyl]hydrazine

[(2-methylphenyl)-(oxan-3-yl)methyl]hydrazine (PubChem CID 105229812) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is [(2-methylphenyl)-(oxan-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-methylphenyl)-(oxan-3-yl)methyl]hydrazine
PubChem CID105229812
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name[(2-methylphenyl)-(oxan-3-yl)methyl]hydrazine
SMILESCc1ccccc1C(NN)C1CCCOC1
InChIInChI=1S/C13H20N2O/c1-10-5-2-3-7-12(10)13(15-14)11-6-4-8-16-9-11/h2-3,5,7,11,13,15H,4,6,8-9,14H2,1H3
InChIKeyGYQKXEJWEAIXQU-UHFFFAOYSA-N
XLogP1.93
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.93
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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Related Compounds

[cyclooctyl-(2-methylphenyl)methyl]hydrazine
CID 105254975
[(5-bromo-2-methylphenyl)-(oxan-3-yl)methyl]hydrazine
CID 107139910
[2,3-dihydro-1-benzofuran-7-yl(oxan-3-yl)methyl]hydrazine
CID 105230130
N-[(2-methylphenyl)-(oxolan-3-yl)methyl]ethanamine
CID 63563797
[(2,4-dimethylphenyl)-(oxolan-3-yl)methyl]hydrazine
CID 105229339
1-(2-bromo-3-methylphenyl)-N-methyl-1-(oxan-3-yl)methanamine
CID 114024257
[(3-ethylcyclohexyl)-(2-methylphenyl)methyl]hydrazine
CID 105200437
[(5-chloro-2-fluorophenyl)-(oxan-3-yl)methyl]hydrazine
CID 107139728
[2-(2,6-dimethylphenyl)-1-(oxan-3-yl)ethyl]hydrazine
CID 105229996
[(2,4-difluorophenyl)-(oxan-3-yl)methyl]hydrazine
CID 105229979
[(5-chloro-2-methylphenyl)-(oxolan-3-yl)methyl]hydrazine
CID 105306666
[(2,5-dibromophenyl)-(oxan-3-yl)methyl]hydrazine
CID 107139773

Frequently Asked Questions

What is the IUPAC name of [(2-methylphenyl)-(oxan-3-yl)methyl]hydrazine?
The IUPAC name of [(2-methylphenyl)-(oxan-3-yl)methyl]hydrazine (CID 105229812) is [(2-methylphenyl)-(oxan-3-yl)methyl]hydrazine.
What is the SMILES notation for [(2-methylphenyl)-(oxan-3-yl)methyl]hydrazine?
The canonical SMILES for [(2-methylphenyl)-(oxan-3-yl)methyl]hydrazine is Cc1ccccc1C(NN)C1CCCOC1.
What is the InChIKey of [(2-methylphenyl)-(oxan-3-yl)methyl]hydrazine?
The InChIKey is GYQKXEJWEAIXQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-10-5-2-3-7-12(10)13(15-14)11-6-4-8-16-9-11/h2-3,5,7,11,13,15H,4,6,8-9,14H2,1H3.
What are the key properties of [(2-methylphenyl)-(oxan-3-yl)methyl]hydrazine?
[(2-methylphenyl)-(oxan-3-yl)methyl]hydrazine has a molecular weight of 220.32 g/mol, XLogP of 1.93, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-methylphenyl)-(oxan-3-yl)methyl]hydrazine is sourced from PubChem (CID 105229812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).