1-(2,6-dichlorophenyl)hept-6-en-2-ylhydrazine

C13H18Cl2N2 — CID 105209700

IUPAC1-(2,6-dichlorophenyl)hept-6-en-2-ylhydrazine
SMILESC=CCCCC(Cc1c(Cl)cccc1Cl)NN
InChIInChI=1S/C13H18Cl2N2/c1-2-3-4-6-10(17-16)9-11-12(14)7-5-8-13(11)15/h2,5,7-8,10,17H,1,3-4,6,9,16H2
InChIKeyXJQJBNJEQKJDBL-UHFFFAOYSA-N
MW273.21 g/mol
LogP3.72
Rot. Bonds7

About 1-(2,6-dichlorophenyl)hept-6-en-2-ylhydrazine

1-(2,6-dichlorophenyl)hept-6-en-2-ylhydrazine (PubChem CID 105209700) has the molecular formula C13H18Cl2N2 and a molecular weight of 273.21 g/mol. Its IUPAC name is 1-(2,6-dichlorophenyl)hept-6-en-2-ylhydrazine.

Molecular Properties

Compound Name1-(2,6-dichlorophenyl)hept-6-en-2-ylhydrazine
PubChem CID105209700
Molecular FormulaC13H18Cl2N2
Molecular Weight273.21 g/mol
Exact Mass272.08
IUPAC Name1-(2,6-dichlorophenyl)hept-6-en-2-ylhydrazine
SMILESC=CCCCC(Cc1c(Cl)cccc1Cl)NN
InChIInChI=1S/C13H18Cl2N2/c1-2-3-4-6-10(17-16)9-11-12(14)7-5-8-13(11)15/h2,5,7-8,10,17H,1,3-4,6,9,16H2
InChIKeyXJQJBNJEQKJDBL-UHFFFAOYSA-N
XLogP3.72
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
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': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 1-(2,6-dichlorophenyl)hept-6-en-2-ylhydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[5-chloro-1-(2,6-dichlorophenyl)pentan-2-yl]hydrazine
CID 105235514
1-(2,6-dichlorophenyl)hex-5-en-1-amine
CID 104986705
[1-(2,6-dichlorophenyl)-4-propoxybutan-2-yl]hydrazine
CID 105293129
1-(2,6-dichlorophenyl)pent-4-enylhydrazine
CID 105311563
1-(3,4-dimethylphenyl)hept-6-en-2-ylhydrazine
CID 105215088
[1-(2,6-dichlorophenyl)-4-(2,2-difluoroethoxy)butan-2-yl]hydrazine
CID 103152068
[1-(2,6-dichlorophenyl)-4-methylidenehexan-2-yl]hydrazine
CID 105209839
[1-(2,6-dichlorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine
CID 105209757
[1-(2,6-dichlorophenyl)-4-methoxypentan-2-yl]hydrazine
CID 105266951
[1-(2,6-dichlorophenyl)-4-(2-methylpyrazol-3-yl)butan-2-yl]hydrazine
CID 103026695
[1-(2,6-dichlorophenyl)-3-(2,3-difluorophenyl)propan-2-yl]hydrazine
CID 105209834
[5-chloro-1-(2,6-difluorophenyl)pentan-2-yl]hydrazine
CID 105235804

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dichlorophenyl)hept-6-en-2-ylhydrazine?
The IUPAC name of 1-(2,6-dichlorophenyl)hept-6-en-2-ylhydrazine (CID 105209700) is 1-(2,6-dichlorophenyl)hept-6-en-2-ylhydrazine.
What is the SMILES notation for 1-(2,6-dichlorophenyl)hept-6-en-2-ylhydrazine?
The canonical SMILES for 1-(2,6-dichlorophenyl)hept-6-en-2-ylhydrazine is C=CCCCC(Cc1c(Cl)cccc1Cl)NN.
What is the InChIKey of 1-(2,6-dichlorophenyl)hept-6-en-2-ylhydrazine?
The InChIKey is XJQJBNJEQKJDBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18Cl2N2/c1-2-3-4-6-10(17-16)9-11-12(14)7-5-8-13(11)15/h2,5,7-8,10,17H,1,3-4,6,9,16H2.
What are the key properties of 1-(2,6-dichlorophenyl)hept-6-en-2-ylhydrazine?
1-(2,6-dichlorophenyl)hept-6-en-2-ylhydrazine has a molecular weight of 273.21 g/mol, XLogP of 3.72, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dichlorophenyl)hept-6-en-2-ylhydrazine is sourced from PubChem (CID 105209700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).