[(3-chloro-4-methylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine

C13H15ClN2OS — CID 107562678

IUPAC[(3-chloro-4-methylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine
SMILESCOc1csc(C(NN)c2ccc(C)c(Cl)c2)c1
InChIInChI=1S/C13H15ClN2OS/c1-8-3-4-9(5-11(8)14)13(16-15)12-6-10(17-2)7-18-12/h3-7,13,16H,15H2,1-2H3
InChIKeyINLMHJDYDUFYEZ-UHFFFAOYSA-N
MW282.80 g/mol
LogP3.27
Rot. Bonds4

About [(3-chloro-4-methylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine

[(3-chloro-4-methylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine (PubChem CID 107562678) has the molecular formula C13H15ClN2OS and a molecular weight of 282.80 g/mol. Its IUPAC name is [(3-chloro-4-methylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-chloro-4-methylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine
PubChem CID107562678
Molecular FormulaC13H15ClN2OS
Molecular Weight282.80 g/mol
Exact Mass282.06
IUPAC Name[(3-chloro-4-methylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine
SMILESCOc1csc(C(NN)c2ccc(C)c(Cl)c2)c1
InChIInChI=1S/C13H15ClN2OS/c1-8-3-4-9(5-11(8)14)13(16-15)12-6-10(17-2)7-18-12/h3-7,13,16H,15H2,1-2H3
InChIKeyINLMHJDYDUFYEZ-UHFFFAOYSA-N
XLogP3.27
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.80
LogP ≤ 53.27
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

[(3,4-dimethylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine
CID 105300329
[(3-chloro-4-methylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine
CID 107562559
N-[(3-chloro-4-methoxyphenyl)-(4-methoxythiophen-2-yl)methyl]propan-1-amine
CID 81121964
1-(4-chloro-3-methoxyphenyl)-1-(4-methoxythiophen-2-yl)-N-methylmethanamine
CID 105007159
1-(4-methoxythiophen-2-yl)-N-methyl-1-(4-propan-2-ylphenyl)methanamine
CID 81126484
[(4-fluoro-2-methylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine
CID 105302541
[(4-methoxythiophen-2-yl)-(3-propylphenyl)methyl]hydrazine
CID 105340625
[(3-chloro-4-methylphenyl)-(4-methylthiophen-3-yl)methyl]hydrazine
CID 107562423
[(3-chloro-4-methylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine
CID 107562588
[(4-methoxy-2,5-dimethylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine
CID 105333054
[(3-chloro-4-methylphenyl)-(2-methylthiophen-3-yl)methyl]hydrazine
CID 102843250
[(3-chloro-4-methylphenyl)-(2-methoxy-4-methylphenyl)methyl]hydrazine
CID 107562509

Frequently Asked Questions

What is the IUPAC name of [(3-chloro-4-methylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine?
The IUPAC name of [(3-chloro-4-methylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine (CID 107562678) is [(3-chloro-4-methylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine.
What is the SMILES notation for [(3-chloro-4-methylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine?
The canonical SMILES for [(3-chloro-4-methylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine is COc1csc(C(NN)c2ccc(C)c(Cl)c2)c1.
What is the InChIKey of [(3-chloro-4-methylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine?
The InChIKey is INLMHJDYDUFYEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2OS/c1-8-3-4-9(5-11(8)14)13(16-15)12-6-10(17-2)7-18-12/h3-7,13,16H,15H2,1-2H3.
What are the key properties of [(3-chloro-4-methylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine?
[(3-chloro-4-methylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine has a molecular weight of 282.80 g/mol, XLogP of 3.27, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-chloro-4-methylphenyl)-(4-methoxythiophen-2-yl)methyl]hydrazine is sourced from PubChem (CID 107562678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).