[1-(2,6-difluorophenyl)-5-methoxy-3-methylpentan-2-yl]hydrazine

C13H20F2N2O — CID 105337870

IUPAC[1-(2,6-difluorophenyl)-5-methoxy-3-methylpentan-2-yl]hydrazine
SMILESCOCCC(C)C(Cc1c(F)cccc1F)NN
InChIInChI=1S/C13H20F2N2O/c1-9(6-7-18-2)13(17-16)8-10-11(14)4-3-5-12(10)15/h3-5,9,13,17H,6-8,16H2,1-2H3
InChIKeyVMKAAMMKPWWFRO-UHFFFAOYSA-N
MW258.31 g/mol
LogP2.01
Rot. Bonds7

About [1-(2,6-difluorophenyl)-5-methoxy-3-methylpentan-2-yl]hydrazine

[1-(2,6-difluorophenyl)-5-methoxy-3-methylpentan-2-yl]hydrazine (PubChem CID 105337870) has the molecular formula C13H20F2N2O and a molecular weight of 258.31 g/mol. Its IUPAC name is [1-(2,6-difluorophenyl)-5-methoxy-3-methylpentan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2,6-difluorophenyl)-5-methoxy-3-methylpentan-2-yl]hydrazine
PubChem CID105337870
Molecular FormulaC13H20F2N2O
Molecular Weight258.31 g/mol
Exact Mass258.15
IUPAC Name[1-(2,6-difluorophenyl)-5-methoxy-3-methylpentan-2-yl]hydrazine
SMILESCOCCC(C)C(Cc1c(F)cccc1F)NN
InChIInChI=1S/C13H20F2N2O/c1-9(6-7-18-2)13(17-16)8-10-11(14)4-3-5-12(10)15/h3-5,9,13,17H,6-8,16H2,1-2H3
InChIKeyVMKAAMMKPWWFRO-UHFFFAOYSA-N
XLogP2.01
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.31
LogP ≤ 52.01
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

[1-(2,6-difluorophenyl)-3,4-dimethylpentan-2-yl]hydrazine
CID 105342903
[1-(2,6-difluorophenyl)-3-ethylpentan-2-yl]hydrazine
CID 105323976
(5-methoxy-3-methyl-1-pyridin-4-ylpentan-2-yl)hydrazine
CID 105212316
[5-methoxy-3-methyl-1-[4-(trifluoromethyl)phenyl]pentan-2-yl]hydrazine
CID 105337979
N-[(2,6-difluorophenyl)methyl]-4-methoxybutan-2-amine
CID 64602570
1-(2,3-difluorophenyl)-5-methoxy-3-methyl-N-propylpentan-2-amine
CID 105044273
[1-(2-chloro-6-fluorophenyl)-3-ethylpentan-2-yl]hydrazine
CID 105215890
[1-(2,6-difluorophenyl)-3-propan-2-yloxypropan-2-yl]hydrazine
CID 105323657
[1-(2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine
CID 105210157
[1-(2,6-difluorophenyl)-4-methylpent-3-en-2-yl]hydrazine
CID 105319719
(1-methoxy-4-methylhexan-3-yl)hydrazine
CID 105206462
2-amino-N-[1-(2,6-difluorophenyl)propan-2-yl]-3-methoxypropanamide
CID 81083554

Frequently Asked Questions

What is the IUPAC name of [1-(2,6-difluorophenyl)-5-methoxy-3-methylpentan-2-yl]hydrazine?
The IUPAC name of [1-(2,6-difluorophenyl)-5-methoxy-3-methylpentan-2-yl]hydrazine (CID 105337870) is [1-(2,6-difluorophenyl)-5-methoxy-3-methylpentan-2-yl]hydrazine.
What is the SMILES notation for [1-(2,6-difluorophenyl)-5-methoxy-3-methylpentan-2-yl]hydrazine?
The canonical SMILES for [1-(2,6-difluorophenyl)-5-methoxy-3-methylpentan-2-yl]hydrazine is COCCC(C)C(Cc1c(F)cccc1F)NN.
What is the InChIKey of [1-(2,6-difluorophenyl)-5-methoxy-3-methylpentan-2-yl]hydrazine?
The InChIKey is VMKAAMMKPWWFRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20F2N2O/c1-9(6-7-18-2)13(17-16)8-10-11(14)4-3-5-12(10)15/h3-5,9,13,17H,6-8,16H2,1-2H3.
What are the key properties of [1-(2,6-difluorophenyl)-5-methoxy-3-methylpentan-2-yl]hydrazine?
[1-(2,6-difluorophenyl)-5-methoxy-3-methylpentan-2-yl]hydrazine has a molecular weight of 258.31 g/mol, XLogP of 2.01, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,6-difluorophenyl)-5-methoxy-3-methylpentan-2-yl]hydrazine is sourced from PubChem (CID 105337870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).