1-(3-chloro-4-methylthiophen-2-yl)hexylhydrazine

C11H19ClN2S — CID 103408484

IUPAC1-(3-chloro-4-methylthiophen-2-yl)hexylhydrazine
SMILESCCCCCC(NN)c1scc(C)c1Cl
InChIInChI=1S/C11H19ClN2S/c1-3-4-5-6-9(14-13)11-10(12)8(2)7-15-11/h7,9,14H,3-6,13H2,1-2H3
InChIKeyWEZUUYDQRKTKJH-UHFFFAOYSA-N
MW246.81 g/mol
LogP3.79
Rot. Bonds6

About 1-(3-chloro-4-methylthiophen-2-yl)hexylhydrazine

1-(3-chloro-4-methylthiophen-2-yl)hexylhydrazine (PubChem CID 103408484) has the molecular formula C11H19ClN2S and a molecular weight of 246.81 g/mol. Its IUPAC name is 1-(3-chloro-4-methylthiophen-2-yl)hexylhydrazine.

Molecular Properties

Compound Name1-(3-chloro-4-methylthiophen-2-yl)hexylhydrazine
PubChem CID103408484
Molecular FormulaC11H19ClN2S
Molecular Weight246.81 g/mol
Exact Mass246.10
IUPAC Name1-(3-chloro-4-methylthiophen-2-yl)hexylhydrazine
SMILESCCCCCC(NN)c1scc(C)c1Cl
InChIInChI=1S/C11H19ClN2S/c1-3-4-5-6-9(14-13)11-10(12)8(2)7-15-11/h7,9,14H,3-6,13H2,1-2H3
InChIKeyWEZUUYDQRKTKJH-UHFFFAOYSA-N
XLogP3.79
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.81
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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-(3-chloro-4-methylthiophen-2-yl)heptylhydrazine
CID 103408474
1-(3-chloro-4-methylthiophen-2-yl)-N-propylnonan-1-amine
CID 103405538
1-(3-chloro-4-methylthiophen-2-yl)hexan-1-ol
CID 103407894
[1-(3-chloro-4-methylthiophen-2-yl)-4-methylsulfonylbutyl]hydrazine
CID 103408445
1-(3-chlorothiophen-2-yl)nonylhydrazine
CID 105294361
1-(3-chloro-4-methylthiophen-2-yl)pentan-1-ol
CID 103407883
1-(3-chloro-4-methylthiophen-2-yl)-4-ethylsulfonyl-N-methylbutan-1-amine
CID 103406210
1-(3-methylthiophen-2-yl)pentylhydrazine
CID 105245717
1-(2-chloro-3-methylphenyl)hexylhydrazine
CID 105294703
1-(3-chloro-4-methylthiophen-2-yl)-4-ethylsulfonyl-N-propylbutan-1-amine
CID 103406216
1-(4-methylthiophen-3-yl)octylhydrazine
CID 105251744
1-(3-chloro-4-methylthiophen-2-yl)-4-phenyl-N-propylbutan-1-amine
CID 103405798

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-4-methylthiophen-2-yl)hexylhydrazine?
The IUPAC name of 1-(3-chloro-4-methylthiophen-2-yl)hexylhydrazine (CID 103408484) is 1-(3-chloro-4-methylthiophen-2-yl)hexylhydrazine.
What is the SMILES notation for 1-(3-chloro-4-methylthiophen-2-yl)hexylhydrazine?
The canonical SMILES for 1-(3-chloro-4-methylthiophen-2-yl)hexylhydrazine is CCCCCC(NN)c1scc(C)c1Cl.
What is the InChIKey of 1-(3-chloro-4-methylthiophen-2-yl)hexylhydrazine?
The InChIKey is WEZUUYDQRKTKJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19ClN2S/c1-3-4-5-6-9(14-13)11-10(12)8(2)7-15-11/h7,9,14H,3-6,13H2,1-2H3.
What are the key properties of 1-(3-chloro-4-methylthiophen-2-yl)hexylhydrazine?
1-(3-chloro-4-methylthiophen-2-yl)hexylhydrazine has a molecular weight of 246.81 g/mol, XLogP of 3.79, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-4-methylthiophen-2-yl)hexylhydrazine is sourced from PubChem (CID 103408484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).