[3-(2,6-dichlorophenyl)-1,1-diethoxypropan-2-yl]hydrazine

C13H20Cl2N2O2 — CID 105246265

IUPAC[3-(2,6-dichlorophenyl)-1,1-diethoxypropan-2-yl]hydrazine
SMILESCCOC(OCC)C(Cc1c(Cl)cccc1Cl)NN
InChIInChI=1S/C13H20Cl2N2O2/c1-3-18-13(19-4-2)12(17-16)8-9-10(14)6-5-7-11(9)15/h5-7,12-13,17H,3-4,8,16H2,1-2H3
InChIKeyDTUVSOKLGVZBSL-UHFFFAOYSA-N
MW307.22 g/mol
LogP2.77
Rot. Bonds8

About [3-(2,6-dichlorophenyl)-1,1-diethoxypropan-2-yl]hydrazine

[3-(2,6-dichlorophenyl)-1,1-diethoxypropan-2-yl]hydrazine (PubChem CID 105246265) has the molecular formula C13H20Cl2N2O2 and a molecular weight of 307.22 g/mol. Its IUPAC name is [3-(2,6-dichlorophenyl)-1,1-diethoxypropan-2-yl]hydrazine.

Molecular Properties

Compound Name[3-(2,6-dichlorophenyl)-1,1-diethoxypropan-2-yl]hydrazine
PubChem CID105246265
Molecular FormulaC13H20Cl2N2O2
Molecular Weight307.22 g/mol
Exact Mass306.09
IUPAC Name[3-(2,6-dichlorophenyl)-1,1-diethoxypropan-2-yl]hydrazine
SMILESCCOC(OCC)C(Cc1c(Cl)cccc1Cl)NN
InChIInChI=1S/C13H20Cl2N2O2/c1-3-18-13(19-4-2)12(17-16)8-9-10(14)6-5-7-11(9)15/h5-7,12-13,17H,3-4,8,16H2,1-2H3
InChIKeyDTUVSOKLGVZBSL-UHFFFAOYSA-N
XLogP2.77
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.22
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[1-(2,3-dichlorophenyl)-3-ethoxybutan-2-yl]hydrazine
CID 107312651
[1-(2-chloro-6-fluorophenyl)-3-ethylpentan-2-yl]hydrazine
CID 105215890
[1-(2-chlorophenyl)-3-ethoxypentan-2-yl]hydrazine
CID 105271076
[1-(2,6-dichlorophenyl)-4-propoxybutan-2-yl]hydrazine
CID 105293129
[1-(2,3-dichlorophenyl)-3-ethoxy-4,4-dimethylpentan-2-yl]hydrazine
CID 107312791
[1-(2,6-dichlorophenyl)-4-methoxypentan-2-yl]hydrazine
CID 105266951
(1,1-diethoxy-3-thiophen-3-ylpropan-2-yl)hydrazine
CID 105246462
1-(2,6-dichlorophenyl)-3-ethoxy-4,4-dimethylpentan-2-amine
CID 116725191
[1-(2,6-dichlorophenyl)-4-methylidenehexan-2-yl]hydrazine
CID 105209839
[1-(2,6-dichlorophenyl)-3,3-dimethylpentan-2-yl]hydrazine
CID 105293201
1-(2,6-dichlorophenyl)but-3-yn-2-ylhydrazine
CID 105209754
[1-(2,6-dichlorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine
CID 105209757

Frequently Asked Questions

What is the IUPAC name of [3-(2,6-dichlorophenyl)-1,1-diethoxypropan-2-yl]hydrazine?
The IUPAC name of [3-(2,6-dichlorophenyl)-1,1-diethoxypropan-2-yl]hydrazine (CID 105246265) is [3-(2,6-dichlorophenyl)-1,1-diethoxypropan-2-yl]hydrazine.
What is the SMILES notation for [3-(2,6-dichlorophenyl)-1,1-diethoxypropan-2-yl]hydrazine?
The canonical SMILES for [3-(2,6-dichlorophenyl)-1,1-diethoxypropan-2-yl]hydrazine is CCOC(OCC)C(Cc1c(Cl)cccc1Cl)NN.
What is the InChIKey of [3-(2,6-dichlorophenyl)-1,1-diethoxypropan-2-yl]hydrazine?
The InChIKey is DTUVSOKLGVZBSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20Cl2N2O2/c1-3-18-13(19-4-2)12(17-16)8-9-10(14)6-5-7-11(9)15/h5-7,12-13,17H,3-4,8,16H2,1-2H3.
What are the key properties of [3-(2,6-dichlorophenyl)-1,1-diethoxypropan-2-yl]hydrazine?
[3-(2,6-dichlorophenyl)-1,1-diethoxypropan-2-yl]hydrazine has a molecular weight of 307.22 g/mol, XLogP of 2.77, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2,6-dichlorophenyl)-1,1-diethoxypropan-2-yl]hydrazine is sourced from PubChem (CID 105246265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).