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

C13H15ClN2OS — CID 105258417

IUPAC[(5-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine
SMILESCOc1ccc(C(NN)c2ccc(Cl)s2)cc1C
InChIInChI=1S/C13H15ClN2OS/c1-8-7-9(3-4-10(8)17-2)13(16-15)11-5-6-12(14)18-11/h3-7,13,16H,15H2,1-2H3
InChIKeyZXHSCUUYKSHELT-UHFFFAOYSA-N
MW282.80 g/mol
LogP3.27
Rot. Bonds4

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

[(5-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine (PubChem CID 105258417) has the molecular formula C13H15ClN2OS and a molecular weight of 282.80 g/mol. Its IUPAC name is [(5-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine
PubChem CID105258417
Molecular FormulaC13H15ClN2OS
Molecular Weight282.80 g/mol
Exact Mass282.06
IUPAC Name[(5-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine
SMILESCOc1ccc(C(NN)c2ccc(Cl)s2)cc1C
InChIInChI=1S/C13H15ClN2OS/c1-8-7-9(3-4-10(8)17-2)13(16-15)11-5-6-12(14)18-11/h3-7,13,16H,15H2,1-2H3
InChIKeyZXHSCUUYKSHELT-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

[(5-chlorothiophen-2-yl)-(3-fluoro-4-methoxyphenyl)methyl]hydrazine
CID 105303967
[(4-chlorophenyl)-(4-methoxy-3-methylphenyl)methyl]hydrazine
CID 105258369
[(4-chloro-3-methoxyphenyl)-(4-methoxy-3-methylphenyl)methyl]hydrazine
CID 105258314
[(5-chlorothiophen-2-yl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
CID 105330834
[(3-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine
CID 107362142
[(3-bromo-4-methoxyphenyl)-(5-methylthiophen-2-yl)methyl]hydrazine
CID 105318789
1-(3-bromo-4-methoxyphenyl)-1-(5-chlorothiophen-2-yl)-N-methylmethanamine
CID 61034062
[(5-chlorothiophen-2-yl)-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105313241
[(5-chlorothiophen-2-yl)-(5-methylfuran-3-yl)methyl]hydrazine
CID 105328238
[(5-chlorothiophen-2-yl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine
CID 105328158
5-chloro-3-[hydrazinyl-(4-methoxy-3-methylphenyl)methyl]pyridin-2-amine
CID 105258421
2-[(3-bromo-4-methoxyphenyl)-chloromethyl]-5-chlorothiophene
CID 63427355

Frequently Asked Questions

What is the IUPAC name of [(5-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine?
The IUPAC name of [(5-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine (CID 105258417) is [(5-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine.
What is the SMILES notation for [(5-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine?
The canonical SMILES for [(5-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine is COc1ccc(C(NN)c2ccc(Cl)s2)cc1C.
What is the InChIKey of [(5-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine?
The InChIKey is ZXHSCUUYKSHELT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2OS/c1-8-7-9(3-4-10(8)17-2)13(16-15)11-5-6-12(14)18-11/h3-7,13,16H,15H2,1-2H3.
What are the key properties of [(5-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine?
[(5-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)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 [(5-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine is sourced from PubChem (CID 105258417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).