[(3,4-dichlorophenyl)-(3-ethylthiophen-2-yl)methyl]hydrazine

C13H14Cl2N2S — CID 105281278

IUPAC[(3,4-dichlorophenyl)-(3-ethylthiophen-2-yl)methyl]hydrazine
SMILESCCc1ccsc1C(NN)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C13H14Cl2N2S/c1-2-8-5-6-18-13(8)12(17-16)9-3-4-10(14)11(15)7-9/h3-7,12,17H,2,16H2,1H3
InChIKeyYYYLHPQBPKTIGB-UHFFFAOYSA-N
MW301.24 g/mol
LogP4.17
Rot. Bonds4

About [(3,4-dichlorophenyl)-(3-ethylthiophen-2-yl)methyl]hydrazine

[(3,4-dichlorophenyl)-(3-ethylthiophen-2-yl)methyl]hydrazine (PubChem CID 105281278) has the molecular formula C13H14Cl2N2S and a molecular weight of 301.24 g/mol. Its IUPAC name is [(3,4-dichlorophenyl)-(3-ethylthiophen-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,4-dichlorophenyl)-(3-ethylthiophen-2-yl)methyl]hydrazine
PubChem CID105281278
Molecular FormulaC13H14Cl2N2S
Molecular Weight301.24 g/mol
Exact Mass300.03
IUPAC Name[(3,4-dichlorophenyl)-(3-ethylthiophen-2-yl)methyl]hydrazine
SMILESCCc1ccsc1C(NN)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C13H14Cl2N2S/c1-2-8-5-6-18-13(8)12(17-16)9-3-4-10(14)11(15)7-9/h3-7,12,17H,2,16H2,1H3
InChIKeyYYYLHPQBPKTIGB-UHFFFAOYSA-N
XLogP4.17
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.24
LogP ≤ 54.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

[(3-chlorothiophen-2-yl)-(3-ethylthiophen-2-yl)methyl]hydrazine
CID 107362343
[(3-ethylthiophen-2-yl)-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105313192
[(4-cyclobutylphenyl)-(3-ethylthiophen-2-yl)methyl]hydrazine
CID 105338117
[(3-ethylthiophen-2-yl)-(3-propylphenyl)methyl]hydrazine
CID 105340477
[3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(3-ethylthiophen-2-yl)methyl]hydrazine
CID 105302894
[(4-chloro-1-methylpyrazol-5-yl)-(3-ethylthiophen-2-yl)methyl]hydrazine
CID 105338782
[(3-ethylthiophen-2-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330057
[(3,4-dichlorophenyl)-(4-propan-2-ylphenyl)methyl]hydrazine
CID 105194109
[(3,4-dichlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
CID 105281260
N-[(2,5-dichlorophenyl)-(3-ethylthiophen-2-yl)methyl]ethanamine
CID 79985462
[(3-ethylthiophen-2-yl)-naphthalen-1-ylmethyl]hydrazine
CID 105301201
(4-chloro-3-methoxyphenyl)-(3-ethylthiophen-2-yl)methanamine
CID 105006834

Frequently Asked Questions

What is the IUPAC name of [(3,4-dichlorophenyl)-(3-ethylthiophen-2-yl)methyl]hydrazine?
The IUPAC name of [(3,4-dichlorophenyl)-(3-ethylthiophen-2-yl)methyl]hydrazine (CID 105281278) is [(3,4-dichlorophenyl)-(3-ethylthiophen-2-yl)methyl]hydrazine.
What is the SMILES notation for [(3,4-dichlorophenyl)-(3-ethylthiophen-2-yl)methyl]hydrazine?
The canonical SMILES for [(3,4-dichlorophenyl)-(3-ethylthiophen-2-yl)methyl]hydrazine is CCc1ccsc1C(NN)c1ccc(Cl)c(Cl)c1.
What is the InChIKey of [(3,4-dichlorophenyl)-(3-ethylthiophen-2-yl)methyl]hydrazine?
The InChIKey is YYYLHPQBPKTIGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14Cl2N2S/c1-2-8-5-6-18-13(8)12(17-16)9-3-4-10(14)11(15)7-9/h3-7,12,17H,2,16H2,1H3.
What are the key properties of [(3,4-dichlorophenyl)-(3-ethylthiophen-2-yl)methyl]hydrazine?
[(3,4-dichlorophenyl)-(3-ethylthiophen-2-yl)methyl]hydrazine has a molecular weight of 301.24 g/mol, XLogP of 4.17, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,4-dichlorophenyl)-(3-ethylthiophen-2-yl)methyl]hydrazine is sourced from PubChem (CID 105281278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).