[(5-chlorothiophen-2-yl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine

C12H12ClFN2OS — CID 105330834

IUPAC[(5-chlorothiophen-2-yl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
SMILESCOc1ccc(F)cc1C(NN)c1ccc(Cl)s1
InChIInChI=1S/C12H12ClFN2OS/c1-17-9-3-2-7(14)6-8(9)12(16-15)10-4-5-11(13)18-10/h2-6,12,16H,15H2,1H3
InChIKeyQDMDNSREVADDQF-UHFFFAOYSA-N
MW286.76 g/mol
LogP3.10
Rot. Bonds4

About [(5-chlorothiophen-2-yl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine

[(5-chlorothiophen-2-yl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine (PubChem CID 105330834) has the molecular formula C12H12ClFN2OS and a molecular weight of 286.76 g/mol. Its IUPAC name is [(5-chlorothiophen-2-yl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-chlorothiophen-2-yl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
PubChem CID105330834
Molecular FormulaC12H12ClFN2OS
Molecular Weight286.76 g/mol
Exact Mass286.03
IUPAC Name[(5-chlorothiophen-2-yl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
SMILESCOc1ccc(F)cc1C(NN)c1ccc(Cl)s1
InChIInChI=1S/C12H12ClFN2OS/c1-17-9-3-2-7(14)6-8(9)12(16-15)10-4-5-11(13)18-10/h2-6,12,16H,15H2,1H3
InChIKeyQDMDNSREVADDQF-UHFFFAOYSA-N
XLogP3.10
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.76
LogP ≤ 53.10
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
[(5-chlorothiophen-2-yl)-(4-methoxy-3-methylphenyl)methyl]hydrazine
CID 105258417
[(2-chloro-4-methylphenyl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
CID 106860165
[(3,5-dimethylphenyl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
CID 105330877
[(5-fluoro-2-methoxyphenyl)-(4-methylphenyl)methyl]hydrazine
CID 105194406
[(4-bromophenyl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
CID 105192470
[(3-bromo-4-methoxyphenyl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
CID 105330905
(2,5-dichlorothiophen-3-yl)-(5-fluoro-2-methoxyphenyl)methanamine
CID 107960548
[(4-bromo-2-fluorophenyl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
CID 105280978
N-[(5-bromothiophen-2-yl)-(5-fluoro-2-methoxyphenyl)methyl]ethanamine
CID 43492175
[(2-bromo-5-fluorophenyl)-(2-methoxy-5-methylphenyl)methyl]hydrazine
CID 105303569
4-fluoro-1-methoxy-2-propan-2-ylbenzene
CID 53399241

Frequently Asked Questions

What is the IUPAC name of [(5-chlorothiophen-2-yl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine?
The IUPAC name of [(5-chlorothiophen-2-yl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine (CID 105330834) is [(5-chlorothiophen-2-yl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(5-chlorothiophen-2-yl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine?
The canonical SMILES for [(5-chlorothiophen-2-yl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine is COc1ccc(F)cc1C(NN)c1ccc(Cl)s1.
What is the InChIKey of [(5-chlorothiophen-2-yl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine?
The InChIKey is QDMDNSREVADDQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12ClFN2OS/c1-17-9-3-2-7(14)6-8(9)12(16-15)10-4-5-11(13)18-10/h2-6,12,16H,15H2,1H3.
What are the key properties of [(5-chlorothiophen-2-yl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine?
[(5-chlorothiophen-2-yl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine has a molecular weight of 286.76 g/mol, XLogP of 3.10, 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)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105330834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).