[1-(2,6-dichlorophenyl)-4-methylidenehexan-2-yl]hydrazine

C13H18Cl2N2 — CID 105209839

IUPAC[1-(2,6-dichlorophenyl)-4-methylidenehexan-2-yl]hydrazine
SMILESC=C(CC)CC(Cc1c(Cl)cccc1Cl)NN
InChIInChI=1S/C13H18Cl2N2/c1-3-9(2)7-10(17-16)8-11-12(14)5-4-6-13(11)15/h4-6,10,17H,2-3,7-8,16H2,1H3
InChIKeyWRYXMNLVRLAOTC-UHFFFAOYSA-N
MW273.21 g/mol
LogP3.72
Rot. Bonds6

About [1-(2,6-dichlorophenyl)-4-methylidenehexan-2-yl]hydrazine

[1-(2,6-dichlorophenyl)-4-methylidenehexan-2-yl]hydrazine (PubChem CID 105209839) has the molecular formula C13H18Cl2N2 and a molecular weight of 273.21 g/mol. Its IUPAC name is [1-(2,6-dichlorophenyl)-4-methylidenehexan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2,6-dichlorophenyl)-4-methylidenehexan-2-yl]hydrazine
PubChem CID105209839
Molecular FormulaC13H18Cl2N2
Molecular Weight273.21 g/mol
Exact Mass272.08
IUPAC Name[1-(2,6-dichlorophenyl)-4-methylidenehexan-2-yl]hydrazine
SMILESC=C(CC)CC(Cc1c(Cl)cccc1Cl)NN
InChIInChI=1S/C13H18Cl2N2/c1-3-9(2)7-10(17-16)8-11-12(14)5-4-6-13(11)15/h4-6,10,17H,2-3,7-8,16H2,1H3
InChIKeyWRYXMNLVRLAOTC-UHFFFAOYSA-N
XLogP3.72
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.21
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(2-chloro-6-fluorophenyl)-N-ethyl-4-methylidenehexan-2-amine
CID 66040411
[1-(2,6-dichlorophenyl)-4-propoxybutan-2-yl]hydrazine
CID 105293129
[5-chloro-1-(2,6-dichlorophenyl)pentan-2-yl]hydrazine
CID 105235514
[1-(2,6-dichlorophenyl)-4-methoxypentan-2-yl]hydrazine
CID 105266951
[1-(2,6-dichlorophenyl)-3-(3-ethyl-1-methylpyrazol-5-yl)propan-2-yl]hydrazine
CID 105209868
1-(2,6-dichlorophenyl)hept-6-en-2-ylhydrazine
CID 105209700
1-(2,6-dichlorophenyl)but-3-yn-2-ylhydrazine
CID 105209754
[1-(3,4-dimethoxyphenyl)-4-methylidenehexan-2-yl]hydrazine
CID 105203952
[1-(2,6-dichlorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine
CID 105209757
[3-(2,6-dichlorophenyl)-1,1-diethoxypropan-2-yl]hydrazine
CID 105246265
[1-(2,6-dichlorophenyl)-6,6-dimethylhept-4-yn-2-yl]hydrazine
CID 114190753
[1-(2-chloro-6-fluorophenyl)-3-methylsulfanylpropan-2-yl]hydrazine
CID 105213730

Frequently Asked Questions

What is the IUPAC name of [1-(2,6-dichlorophenyl)-4-methylidenehexan-2-yl]hydrazine?
The IUPAC name of [1-(2,6-dichlorophenyl)-4-methylidenehexan-2-yl]hydrazine (CID 105209839) is [1-(2,6-dichlorophenyl)-4-methylidenehexan-2-yl]hydrazine.
What is the SMILES notation for [1-(2,6-dichlorophenyl)-4-methylidenehexan-2-yl]hydrazine?
The canonical SMILES for [1-(2,6-dichlorophenyl)-4-methylidenehexan-2-yl]hydrazine is C=C(CC)CC(Cc1c(Cl)cccc1Cl)NN.
What is the InChIKey of [1-(2,6-dichlorophenyl)-4-methylidenehexan-2-yl]hydrazine?
The InChIKey is WRYXMNLVRLAOTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18Cl2N2/c1-3-9(2)7-10(17-16)8-11-12(14)5-4-6-13(11)15/h4-6,10,17H,2-3,7-8,16H2,1H3.
What are the key properties of [1-(2,6-dichlorophenyl)-4-methylidenehexan-2-yl]hydrazine?
[1-(2,6-dichlorophenyl)-4-methylidenehexan-2-yl]hydrazine has a molecular weight of 273.21 g/mol, XLogP of 3.72, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,6-dichlorophenyl)-4-methylidenehexan-2-yl]hydrazine is sourced from PubChem (CID 105209839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).