[1-(3-chlorothiophen-2-yl)-2-methoxy-2-phenylethyl]hydrazine

C13H15ClN2OS — CID 107362207

IUPAC[1-(3-chlorothiophen-2-yl)-2-methoxy-2-phenylethyl]hydrazine
SMILESCOC(c1ccccc1)C(NN)c1sccc1Cl
InChIInChI=1S/C13H15ClN2OS/c1-17-12(9-5-3-2-4-6-9)11(16-15)13-10(14)7-8-18-13/h2-8,11-12,16H,15H2,1H3
InChIKeyTVJPCZKZNUAFOK-UHFFFAOYSA-N
MW282.80 g/mol
LogP3.29
Rot. Bonds5

About [1-(3-chlorothiophen-2-yl)-2-methoxy-2-phenylethyl]hydrazine

[1-(3-chlorothiophen-2-yl)-2-methoxy-2-phenylethyl]hydrazine (PubChem CID 107362207) has the molecular formula C13H15ClN2OS and a molecular weight of 282.80 g/mol. Its IUPAC name is [1-(3-chlorothiophen-2-yl)-2-methoxy-2-phenylethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-chlorothiophen-2-yl)-2-methoxy-2-phenylethyl]hydrazine
PubChem CID107362207
Molecular FormulaC13H15ClN2OS
Molecular Weight282.80 g/mol
Exact Mass282.06
IUPAC Name[1-(3-chlorothiophen-2-yl)-2-methoxy-2-phenylethyl]hydrazine
SMILESCOC(c1ccccc1)C(NN)c1sccc1Cl
InChIInChI=1S/C13H15ClN2OS/c1-17-12(9-5-3-2-4-6-9)11(16-15)13-10(14)7-8-18-13/h2-8,11-12,16H,15H2,1H3
InChIKeyTVJPCZKZNUAFOK-UHFFFAOYSA-N
XLogP3.29
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.80
LogP ≤ 53.29
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

1-(3-bromothiophen-2-yl)-N-ethyl-2-methoxy-2-phenylethanamine
CID 116773064
[1-(furan-3-yl)-2-methoxy-2-phenylethyl]hydrazine
CID 105279158
[(3-chlorothiophen-2-yl)-(4-methoxyphenyl)methyl]hydrazine
CID 105286186
1-(3-chlorothiophen-2-yl)-2-phenyl-N-propylbutan-1-amine
CID 80529506
[1-(2,3-dimethylphenyl)-2-methoxy-2-phenylethyl]hydrazine
CID 105279006
1-(3-chlorothiophen-2-yl)-2-methoxy-N,3-dimethylbutan-1-amine
CID 107360216
[1-(3-chlorothiophen-2-yl)-4-methoxy-3-methylbutyl]hydrazine
CID 107362431
1-(4-chlorophenyl)-2-methoxy-N-methyl-2-phenylethanamine
CID 116772626
[2-methoxy-1-(4-methoxy-2-methylphenyl)-2-phenylethyl]hydrazine
CID 105279171
N-[(3-chlorothiophen-2-yl)-phenylmethyl]propan-1-amine
CID 80529572
[1-(3-chlorothiophen-2-yl)-3-methoxy-3-methylbutyl]hydrazine
CID 107362297
[(3-chloro-4-methylthiophen-2-yl)-phenylmethyl]hydrazine
CID 103408376

Frequently Asked Questions

What is the IUPAC name of [1-(3-chlorothiophen-2-yl)-2-methoxy-2-phenylethyl]hydrazine?
The IUPAC name of [1-(3-chlorothiophen-2-yl)-2-methoxy-2-phenylethyl]hydrazine (CID 107362207) is [1-(3-chlorothiophen-2-yl)-2-methoxy-2-phenylethyl]hydrazine.
What is the SMILES notation for [1-(3-chlorothiophen-2-yl)-2-methoxy-2-phenylethyl]hydrazine?
The canonical SMILES for [1-(3-chlorothiophen-2-yl)-2-methoxy-2-phenylethyl]hydrazine is COC(c1ccccc1)C(NN)c1sccc1Cl.
What is the InChIKey of [1-(3-chlorothiophen-2-yl)-2-methoxy-2-phenylethyl]hydrazine?
The InChIKey is TVJPCZKZNUAFOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2OS/c1-17-12(9-5-3-2-4-6-9)11(16-15)13-10(14)7-8-18-13/h2-8,11-12,16H,15H2,1H3.
What are the key properties of [1-(3-chlorothiophen-2-yl)-2-methoxy-2-phenylethyl]hydrazine?
[1-(3-chlorothiophen-2-yl)-2-methoxy-2-phenylethyl]hydrazine has a molecular weight of 282.80 g/mol, XLogP of 3.29, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chlorothiophen-2-yl)-2-methoxy-2-phenylethyl]hydrazine is sourced from PubChem (CID 107362207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).