[(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine

C13H14Cl2N2OS — CID 107970267

IUPAC[(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine
SMILESCCOc1ccccc1C(NN)c1cc(Cl)sc1Cl
InChIInChI=1S/C13H14Cl2N2OS/c1-2-18-10-6-4-3-5-8(10)12(17-16)9-7-11(14)19-13(9)15/h3-7,12,17H,2,16H2,1H3
InChIKeyDWCYHBVFJAAGAP-UHFFFAOYSA-N
MW317.24 g/mol
LogP4.01
Rot. Bonds5

About [(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine

[(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine (PubChem CID 107970267) has the molecular formula C13H14Cl2N2OS and a molecular weight of 317.24 g/mol. Its IUPAC name is [(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine
PubChem CID107970267
Molecular FormulaC13H14Cl2N2OS
Molecular Weight317.24 g/mol
Exact Mass316.02
IUPAC Name[(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine
SMILESCCOc1ccccc1C(NN)c1cc(Cl)sc1Cl
InChIInChI=1S/C13H14Cl2N2OS/c1-2-18-10-6-4-3-5-8(10)12(17-16)9-7-11(14)19-13(9)15/h3-7,12,17H,2,16H2,1H3
InChIKeyDWCYHBVFJAAGAP-UHFFFAOYSA-N
XLogP4.01
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.24
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[(2,5-dichlorothiophen-3-yl)-(2-methylphenyl)methyl]hydrazine
CID 107970076
[(5-chlorofuran-2-yl)-(2-ethoxyphenyl)methyl]hydrazine
CID 106694388
[(2-ethoxyphenyl)-pyridin-2-ylmethyl]hydrazine
CID 105195729
[(3,5-dimethylphenyl)-(2-ethoxyphenyl)methyl]hydrazine
CID 105260811
[(2-ethoxyphenyl)-(2-methylfuran-3-yl)methyl]hydrazine
CID 105268919
[(2-ethoxyphenyl)-(2-fluoro-5-methylphenyl)methyl]hydrazine
CID 105260703
[(5-bromothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine
CID 105304440
[(2-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methyl]hydrazine
CID 105304374
[(2-ethoxyphenyl)-(4-ethoxyphenyl)methyl]hydrazine
CID 105260722
[(2-ethoxyphenyl)-(3-fluorophenyl)methyl]hydrazine
CID 105192906
[(4-chloro-1-methylpyrazol-5-yl)-(2-ethoxyphenyl)methyl]hydrazine
CID 105260785
[(2,5-dichlorothiophen-3-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
CID 107970130

Frequently Asked Questions

What is the IUPAC name of [(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine?
The IUPAC name of [(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine (CID 107970267) is [(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine?
The canonical SMILES for [(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine is CCOc1ccccc1C(NN)c1cc(Cl)sc1Cl.
What is the InChIKey of [(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine?
The InChIKey is DWCYHBVFJAAGAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14Cl2N2OS/c1-2-18-10-6-4-3-5-8(10)12(17-16)9-7-11(14)19-13(9)15/h3-7,12,17H,2,16H2,1H3.
What are the key properties of [(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine?
[(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine has a molecular weight of 317.24 g/mol, XLogP of 4.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 107970267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).