[1-(2,4-difluorophenyl)-4-methoxy-4-methylpentan-2-yl]hydrazine

C13H20F2N2O — CID 103025221

IUPAC[1-(2,4-difluorophenyl)-4-methoxy-4-methylpentan-2-yl]hydrazine
SMILESCOC(C)(C)CC(Cc1ccc(F)cc1F)NN
InChIInChI=1S/C13H20F2N2O/c1-13(2,18-3)8-11(17-16)6-9-4-5-10(14)7-12(9)15/h4-5,7,11,17H,6,8,16H2,1-3H3
InChIKeyWXDYTDQVQYUXPR-UHFFFAOYSA-N
MW258.31 g/mol
LogP2.15
Rot. Bonds6

About [1-(2,4-difluorophenyl)-4-methoxy-4-methylpentan-2-yl]hydrazine

[1-(2,4-difluorophenyl)-4-methoxy-4-methylpentan-2-yl]hydrazine (PubChem CID 103025221) has the molecular formula C13H20F2N2O and a molecular weight of 258.31 g/mol. Its IUPAC name is [1-(2,4-difluorophenyl)-4-methoxy-4-methylpentan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2,4-difluorophenyl)-4-methoxy-4-methylpentan-2-yl]hydrazine
PubChem CID103025221
Molecular FormulaC13H20F2N2O
Molecular Weight258.31 g/mol
Exact Mass258.15
IUPAC Name[1-(2,4-difluorophenyl)-4-methoxy-4-methylpentan-2-yl]hydrazine
SMILESCOC(C)(C)CC(Cc1ccc(F)cc1F)NN
InChIInChI=1S/C13H20F2N2O/c1-13(2,18-3)8-11(17-16)6-9-4-5-10(14)7-12(9)15/h4-5,7,11,17H,6,8,16H2,1-3H3
InChIKeyWXDYTDQVQYUXPR-UHFFFAOYSA-N
XLogP2.15
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.31
LogP ≤ 52.15
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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Frequently Asked Questions

What is the IUPAC name of [1-(2,4-difluorophenyl)-4-methoxy-4-methylpentan-2-yl]hydrazine?
The IUPAC name of [1-(2,4-difluorophenyl)-4-methoxy-4-methylpentan-2-yl]hydrazine (CID 103025221) is [1-(2,4-difluorophenyl)-4-methoxy-4-methylpentan-2-yl]hydrazine.
What is the SMILES notation for [1-(2,4-difluorophenyl)-4-methoxy-4-methylpentan-2-yl]hydrazine?
The canonical SMILES for [1-(2,4-difluorophenyl)-4-methoxy-4-methylpentan-2-yl]hydrazine is COC(C)(C)CC(Cc1ccc(F)cc1F)NN.
What is the InChIKey of [1-(2,4-difluorophenyl)-4-methoxy-4-methylpentan-2-yl]hydrazine?
The InChIKey is WXDYTDQVQYUXPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20F2N2O/c1-13(2,18-3)8-11(17-16)6-9-4-5-10(14)7-12(9)15/h4-5,7,11,17H,6,8,16H2,1-3H3.
What are the key properties of [1-(2,4-difluorophenyl)-4-methoxy-4-methylpentan-2-yl]hydrazine?
[1-(2,4-difluorophenyl)-4-methoxy-4-methylpentan-2-yl]hydrazine has a molecular weight of 258.31 g/mol, XLogP of 2.15, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,4-difluorophenyl)-4-methoxy-4-methylpentan-2-yl]hydrazine is sourced from PubChem (CID 103025221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).