1-(2,5-dichlorothiophen-3-yl)pent-4-enylhydrazine

C9H12Cl2N2S — CID 107970341

IUPAC1-(2,5-dichlorothiophen-3-yl)pent-4-enylhydrazine
SMILESC=CCCC(NN)c1cc(Cl)sc1Cl
InChIInChI=1S/C9H12Cl2N2S/c1-2-3-4-7(13-12)6-5-8(10)14-9(6)11/h2,5,7,13H,1,3-4,12H2
InChIKeyDUNDJJRNSJRZCP-UHFFFAOYSA-N
MW251.18 g/mol
LogP3.53
Rot. Bonds5

About 1-(2,5-dichlorothiophen-3-yl)pent-4-enylhydrazine

1-(2,5-dichlorothiophen-3-yl)pent-4-enylhydrazine (PubChem CID 107970341) has the molecular formula C9H12Cl2N2S and a molecular weight of 251.18 g/mol. Its IUPAC name is 1-(2,5-dichlorothiophen-3-yl)pent-4-enylhydrazine.

Molecular Properties

Compound Name1-(2,5-dichlorothiophen-3-yl)pent-4-enylhydrazine
PubChem CID107970341
Molecular FormulaC9H12Cl2N2S
Molecular Weight251.18 g/mol
Exact Mass250.01
IUPAC Name1-(2,5-dichlorothiophen-3-yl)pent-4-enylhydrazine
SMILESC=CCCC(NN)c1cc(Cl)sc1Cl
InChIInChI=1S/C9H12Cl2N2S/c1-2-3-4-7(13-12)6-5-8(10)14-9(6)11/h2,5,7,13H,1,3-4,12H2
InChIKeyDUNDJJRNSJRZCP-UHFFFAOYSA-N
XLogP3.53
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.18
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine
CID 107970721
1-(2,5-dichlorothiophen-3-yl)-N-ethylpent-4-en-1-amine
CID 107968368
[3-cyclopropyl-1-(2,5-dichlorothiophen-3-yl)propyl]hydrazine
CID 107970378
[1-(2,5-dichlorothiophen-3-yl)-4,4-dimethylpentyl]hydrazine
CID 107970213
1-(2-chloro-4-fluorophenyl)pent-4-enylhydrazine
CID 105215376
[1-(2,5-dichlorothiophen-3-yl)-2-(oxan-4-yl)ethyl]hydrazine
CID 107970203
[2-(2,6-dichlorophenyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine
CID 107970147
1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine
CID 105280013
[1-(2,5-dichlorothiophen-3-yl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 107970143
1-(4-chloro-3-methylphenyl)pent-4-enylhydrazine
CID 105311524
[2-(3,4-dichlorophenyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine
CID 114022333
1-(2,6-dichlorophenyl)pent-4-enylhydrazine
CID 105311563

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dichlorothiophen-3-yl)pent-4-enylhydrazine?
The IUPAC name of 1-(2,5-dichlorothiophen-3-yl)pent-4-enylhydrazine (CID 107970341) is 1-(2,5-dichlorothiophen-3-yl)pent-4-enylhydrazine.
What is the SMILES notation for 1-(2,5-dichlorothiophen-3-yl)pent-4-enylhydrazine?
The canonical SMILES for 1-(2,5-dichlorothiophen-3-yl)pent-4-enylhydrazine is C=CCCC(NN)c1cc(Cl)sc1Cl.
What is the InChIKey of 1-(2,5-dichlorothiophen-3-yl)pent-4-enylhydrazine?
The InChIKey is DUNDJJRNSJRZCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12Cl2N2S/c1-2-3-4-7(13-12)6-5-8(10)14-9(6)11/h2,5,7,13H,1,3-4,12H2.
What are the key properties of 1-(2,5-dichlorothiophen-3-yl)pent-4-enylhydrazine?
1-(2,5-dichlorothiophen-3-yl)pent-4-enylhydrazine has a molecular weight of 251.18 g/mol, XLogP of 3.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dichlorothiophen-3-yl)pent-4-enylhydrazine is sourced from PubChem (CID 107970341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).