[1-(2-chloro-5-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine

C13H20ClFN2O — CID 102623584

IUPAC[1-(2-chloro-5-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine
SMILESCC(C)(C)OCC(Cc1cc(F)ccc1Cl)NN
InChIInChI=1S/C13H20ClFN2O/c1-13(2,3)18-8-11(17-16)7-9-6-10(15)4-5-12(9)14/h4-6,11,17H,7-8,16H2,1-3H3
InChIKeyYAVOSZAPZSRVGE-UHFFFAOYSA-N
MW274.77 g/mol
LogP2.67
Rot. Bonds5

About [1-(2-chloro-5-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine

[1-(2-chloro-5-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine (PubChem CID 102623584) has the molecular formula C13H20ClFN2O and a molecular weight of 274.77 g/mol. Its IUPAC name is [1-(2-chloro-5-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2-chloro-5-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine
PubChem CID102623584
Molecular FormulaC13H20ClFN2O
Molecular Weight274.77 g/mol
Exact Mass274.12
IUPAC Name[1-(2-chloro-5-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine
SMILESCC(C)(C)OCC(Cc1cc(F)ccc1Cl)NN
InChIInChI=1S/C13H20ClFN2O/c1-13(2,3)18-8-11(17-16)7-9-6-10(15)4-5-12(9)14/h4-6,11,17H,7-8,16H2,1-3H3
InChIKeyYAVOSZAPZSRVGE-UHFFFAOYSA-N
XLogP2.67
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.77
LogP ≤ 52.67
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-(5-chloro-2-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine
CID 103053888
[1-(2-chloro-5-fluorophenyl)-3-(2-methoxyphenyl)propan-2-yl]hydrazine
CID 102623265
[1-(2-chloro-5-fluorophenyl)-3-(3-fluorophenyl)propan-2-yl]hydrazine
CID 102623264
[1-(2-chloro-5-fluorophenyl)-3-ethylsulfanylpropan-2-yl]hydrazine
CID 102623322
1-(2-chloro-5-fluorophenyl)propan-2-ylhydrazine
CID 102623253
[1-(2-methoxyphenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine
CID 105289511
[1-(4-bromo-2-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine
CID 105297513
[1-(2-chloro-5-fluorophenyl)-4-(2-methoxyethoxy)butan-2-yl]hydrazine
CID 102930015
[1-(2-methylphenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine
CID 105285289
3-(2-chloro-5-fluorophenyl)-1,1-diethoxypropan-2-amine
CID 102619111
1-(2-chloro-5-fluorophenyl)-3-ethoxy-3-methylbutan-2-amine
CID 102619367
[1-(2-chloro-5-fluorophenyl)-3-methoxybutan-2-yl]hydrazine
CID 102623380

Frequently Asked Questions

What is the IUPAC name of [1-(2-chloro-5-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine?
The IUPAC name of [1-(2-chloro-5-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine (CID 102623584) is [1-(2-chloro-5-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine.
What is the SMILES notation for [1-(2-chloro-5-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine?
The canonical SMILES for [1-(2-chloro-5-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine is CC(C)(C)OCC(Cc1cc(F)ccc1Cl)NN.
What is the InChIKey of [1-(2-chloro-5-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine?
The InChIKey is YAVOSZAPZSRVGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20ClFN2O/c1-13(2,3)18-8-11(17-16)7-9-6-10(15)4-5-12(9)14/h4-6,11,17H,7-8,16H2,1-3H3.
What are the key properties of [1-(2-chloro-5-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine?
[1-(2-chloro-5-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine has a molecular weight of 274.77 g/mol, XLogP of 2.67, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-chloro-5-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine is sourced from PubChem (CID 102623584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).