[(2,5-dichlorothiophen-3-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine

C13H14Cl2N2OS — CID 107970130

IUPAC[(2,5-dichlorothiophen-3-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
SMILESCOc1ccc(C(NN)c2cc(Cl)sc2Cl)c(C)c1
InChIInChI=1S/C13H14Cl2N2OS/c1-7-5-8(18-2)3-4-9(7)12(17-16)10-6-11(14)19-13(10)15/h3-6,12,17H,16H2,1-2H3
InChIKeySIYKCFGAWBACRP-UHFFFAOYSA-N
MW317.24 g/mol
LogP3.92
Rot. Bonds4

About [(2,5-dichlorothiophen-3-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine

[(2,5-dichlorothiophen-3-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine (PubChem CID 107970130) has the molecular formula C13H14Cl2N2OS and a molecular weight of 317.24 g/mol. Its IUPAC name is [(2,5-dichlorothiophen-3-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,5-dichlorothiophen-3-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
PubChem CID107970130
Molecular FormulaC13H14Cl2N2OS
Molecular Weight317.24 g/mol
Exact Mass316.02
IUPAC Name[(2,5-dichlorothiophen-3-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
SMILESCOc1ccc(C(NN)c2cc(Cl)sc2Cl)c(C)c1
InChIInChI=1S/C13H14Cl2N2OS/c1-7-5-8(18-2)3-4-9(7)12(17-16)10-6-11(14)19-13(10)15/h3-6,12,17H,16H2,1-2H3
InChIKeySIYKCFGAWBACRP-UHFFFAOYSA-N
XLogP3.92
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.24
LogP ≤ 53.92
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
[(4-fluoro-2-methylphenyl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
CID 105256746
[(2,3-dimethylphenyl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
CID 105291474
[(2,6-dimethyl-3-pyridinyl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
CID 105291511
1-(2,5-dichlorothiophen-3-yl)-1-(2,4-dimethylphenyl)-N-methylmethanamine
CID 43486831
[(2,5-dichlorothiophen-3-yl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 107970084
(5-chlorothiophen-2-yl)-(4-methoxy-2-methylphenyl)methanol
CID 62278042
[(2,5-dichlorothiophen-3-yl)-(2-ethoxyphenyl)methyl]hydrazine
CID 107970267
[(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
CID 105291606
[(4-fluoro-3-methoxyphenyl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
CID 105291538
N-[(2,5-dichlorothiophen-3-yl)-(3-methoxyphenyl)methyl]ethanamine
CID 43493094
[(4-methoxy-2-methylphenyl)-(3-methylimidazol-4-yl)methyl]hydrazine
CID 105264785

Frequently Asked Questions

What is the IUPAC name of [(2,5-dichlorothiophen-3-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine?
The IUPAC name of [(2,5-dichlorothiophen-3-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine (CID 107970130) is [(2,5-dichlorothiophen-3-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine.
What is the SMILES notation for [(2,5-dichlorothiophen-3-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine?
The canonical SMILES for [(2,5-dichlorothiophen-3-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine is COc1ccc(C(NN)c2cc(Cl)sc2Cl)c(C)c1.
What is the InChIKey of [(2,5-dichlorothiophen-3-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine?
The InChIKey is SIYKCFGAWBACRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14Cl2N2OS/c1-7-5-8(18-2)3-4-9(7)12(17-16)10-6-11(14)19-13(10)15/h3-6,12,17H,16H2,1-2H3.
What are the key properties of [(2,5-dichlorothiophen-3-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine?
[(2,5-dichlorothiophen-3-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine has a molecular weight of 317.24 g/mol, XLogP of 3.92, 4 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)-(4-methoxy-2-methylphenyl)methyl]hydrazine is sourced from PubChem (CID 107970130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).