[2-(5-chlorothiophen-2-yl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine

C13H13ClF2N2S — CID 105295892

IUPAC[2-(5-chlorothiophen-2-yl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine
SMILESCc1ccc(F)c(C(Cc2ccc(Cl)s2)NN)c1F
InChIInChI=1S/C13H13ClF2N2S/c1-7-2-4-9(15)12(13(7)16)10(18-17)6-8-3-5-11(14)19-8/h2-5,10,18H,6,17H2,1H3
InChIKeyQAVJBRTUIUCZOI-UHFFFAOYSA-N
MW302.78 g/mol
LogP3.74
Rot. Bonds4

About [2-(5-chlorothiophen-2-yl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine

[2-(5-chlorothiophen-2-yl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine (PubChem CID 105295892) has the molecular formula C13H13ClF2N2S and a molecular weight of 302.78 g/mol. Its IUPAC name is [2-(5-chlorothiophen-2-yl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(5-chlorothiophen-2-yl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine
PubChem CID105295892
Molecular FormulaC13H13ClF2N2S
Molecular Weight302.78 g/mol
Exact Mass302.05
IUPAC Name[2-(5-chlorothiophen-2-yl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine
SMILESCc1ccc(F)c(C(Cc2ccc(Cl)s2)NN)c1F
InChIInChI=1S/C13H13ClF2N2S/c1-7-2-4-9(15)12(13(7)16)10(18-17)6-8-3-5-11(14)19-8/h2-5,10,18H,6,17H2,1H3
InChIKeyQAVJBRTUIUCZOI-UHFFFAOYSA-N
XLogP3.74
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.78
LogP ≤ 53.74
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

[2-(2-chlorophenyl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine
CID 105209475
[2-(5-chlorothiophen-2-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine
CID 105208199
[1-(4-chloro-2-fluorophenyl)-2-(5-chlorothiophen-2-yl)ethyl]hydrazine
CID 105217959
1-(2,6-difluoro-3-methylphenyl)-2-(5-ethylthiophen-2-yl)-N-methylethanamine
CID 115842714
[2-(5-chlorothiophen-2-yl)-1-(4-methylthiophen-3-yl)ethyl]hydrazine
CID 105251917
[1-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine
CID 105223092
[2-(5-chlorothiophen-2-yl)-1-(5-methylfuran-2-yl)ethyl]hydrazine
CID 105295997
[2-(5-chlorothiophen-2-yl)-1-(2,3-dimethylphenyl)ethyl]hydrazine
CID 105295852
[1-(2,6-difluoro-3-methylphenyl)-2-pyridin-4-ylethyl]hydrazine
CID 105212355
[1-(5-chloro-2-pyridinyl)-2-(5-chlorothiophen-2-yl)ethyl]hydrazine
CID 105251592
3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine
CID 105259156
1-(5-chloro-2-fluorophenyl)-2-(5-chlorothiophen-2-yl)-N-methylethanamine
CID 114886081

Frequently Asked Questions

What is the IUPAC name of [2-(5-chlorothiophen-2-yl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine?
The IUPAC name of [2-(5-chlorothiophen-2-yl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine (CID 105295892) is [2-(5-chlorothiophen-2-yl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(5-chlorothiophen-2-yl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine?
The canonical SMILES for [2-(5-chlorothiophen-2-yl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine is Cc1ccc(F)c(C(Cc2ccc(Cl)s2)NN)c1F.
What is the InChIKey of [2-(5-chlorothiophen-2-yl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine?
The InChIKey is QAVJBRTUIUCZOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClF2N2S/c1-7-2-4-9(15)12(13(7)16)10(18-17)6-8-3-5-11(14)19-8/h2-5,10,18H,6,17H2,1H3.
What are the key properties of [2-(5-chlorothiophen-2-yl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine?
[2-(5-chlorothiophen-2-yl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine has a molecular weight of 302.78 g/mol, XLogP of 3.74, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-chlorothiophen-2-yl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105295892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).