1-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine

C12H18Cl2N2S — CID 107970721

IUPAC1-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine
SMILESC=CCCCCCC(NN)c1cc(Cl)sc1Cl
InChIInChI=1S/C12H18Cl2N2S/c1-2-3-4-5-6-7-10(16-15)9-8-11(13)17-12(9)14/h2,8,10,16H,1,3-7,15H2
InChIKeyNFCKKNRUDODJTE-UHFFFAOYSA-N
MW293.26 g/mol
LogP4.70
Rot. Bonds8

About 1-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine

1-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine (PubChem CID 107970721) has the molecular formula C12H18Cl2N2S and a molecular weight of 293.26 g/mol. Its IUPAC name is 1-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine.

Molecular Properties

Compound Name1-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine
PubChem CID107970721
Molecular FormulaC12H18Cl2N2S
Molecular Weight293.26 g/mol
Exact Mass292.06
IUPAC Name1-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine
SMILESC=CCCCCCC(NN)c1cc(Cl)sc1Cl
InChIInChI=1S/C12H18Cl2N2S/c1-2-3-4-5-6-7-10(16-15)9-8-11(13)17-12(9)14/h2,8,10,16H,1,3-7,15H2
InChIKeyNFCKKNRUDODJTE-UHFFFAOYSA-N
XLogP4.70
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.26
LogP ≤ 54.70
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': '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)pent-4-enylhydrazine
CID 107970341
1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine
CID 107997433
1-(2,5-dichlorothiophen-3-yl)-N-ethylpent-4-en-1-amine
CID 107968368
1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine
CID 105280013
[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-(3-chloro-4-pyridinyl)oct-7-enylhydrazine
CID 107012984
1-(5-chloro-2-methylphenyl)hex-5-enylhydrazine
CID 105311435
4-fluoro-2-(1-hydrazinyloct-7-enyl)aniline
CID 107012619
1-(3,5-dichloro-2-pyridinyl)oct-7-enylhydrazine
CID 107012565
1-(5-bromothiophen-2-yl)oct-7-enylhydrazine
CID 107012478
1-thiophen-2-yloct-7-enylhydrazine
CID 107012375

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine?
The IUPAC name of 1-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine (CID 107970721) is 1-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine.
What is the SMILES notation for 1-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine?
The canonical SMILES for 1-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine is C=CCCCCCC(NN)c1cc(Cl)sc1Cl.
What is the InChIKey of 1-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine?
The InChIKey is NFCKKNRUDODJTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18Cl2N2S/c1-2-3-4-5-6-7-10(16-15)9-8-11(13)17-12(9)14/h2,8,10,16H,1,3-7,15H2.
What are the key properties of 1-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine?
1-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine has a molecular weight of 293.26 g/mol, XLogP of 4.70, 8 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)oct-7-enylhydrazine is sourced from PubChem (CID 107970721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).