[2-(2,5-difluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine

C13H19F2N3S — CID 106446251

IUPAC[2-(2,5-difluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
SMILESCN1CCSCC1C(Cc1cc(F)ccc1F)NN
InChIInChI=1S/C13H19F2N3S/c1-18-4-5-19-8-13(18)12(17-16)7-9-6-10(14)2-3-11(9)15/h2-3,6,12-13,17H,4-5,7-8,16H2,1H3
InChIKeyNEUHFEULNDJNKK-UHFFFAOYSA-N
MW287.38 g/mol
LogP1.39
Rot. Bonds4

About [2-(2,5-difluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine

[2-(2,5-difluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine (PubChem CID 106446251) has the molecular formula C13H19F2N3S and a molecular weight of 287.38 g/mol. Its IUPAC name is [2-(2,5-difluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2,5-difluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
PubChem CID106446251
Molecular FormulaC13H19F2N3S
Molecular Weight287.38 g/mol
Exact Mass287.13
IUPAC Name[2-(2,5-difluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
SMILESCN1CCSCC1C(Cc1cc(F)ccc1F)NN
InChIInChI=1S/C13H19F2N3S/c1-18-4-5-19-8-13(18)12(17-16)7-9-6-10(14)2-3-11(9)15/h2-3,6,12-13,17H,4-5,7-8,16H2,1H3
InChIKeyNEUHFEULNDJNKK-UHFFFAOYSA-N
XLogP1.39
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.38
LogP ≤ 51.39
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

[2-(2-chloro-5-fluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
CID 106446395
[2-(2,5-difluorophenyl)-1-(1,4-dimethylpiperazin-2-yl)ethyl]hydrazine
CID 105247218
[2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
CID 106446450
2-(5-chloro-2-fluorophenyl)-N-methyl-1-(4-methylthiomorpholin-3-yl)ethanamine
CID 106444713
2-(2-chloro-5-fluorophenyl)-N-methyl-1-(4-methylthiomorpholin-3-yl)ethanamine
CID 106444833
[2-(4-ethylphenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
CID 106446480
N-[2-(2,4-difluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]propan-1-amine
CID 106445370
[1-(4-methylthiomorpholin-3-yl)-2-phenylethyl]hydrazine
CID 106446350
2-(2-bromo-4-fluorophenyl)-N-methyl-1-(4-methylthiomorpholin-3-yl)ethanamine
CID 106444804
[2-(5-bromo-2-methoxyphenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
CID 106446415
3-[2-hydrazinyl-2-(4-methylthiomorpholin-3-yl)ethyl]pyridin-2-amine
CID 106446527
2-(3,4-difluorophenyl)-N-methyl-1-(4-methylthiomorpholin-3-yl)ethanamine
CID 106444825

Frequently Asked Questions

What is the IUPAC name of [2-(2,5-difluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(2,5-difluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine (CID 106446251) is [2-(2,5-difluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2,5-difluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2,5-difluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine is CN1CCSCC1C(Cc1cc(F)ccc1F)NN.
What is the InChIKey of [2-(2,5-difluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine?
The InChIKey is NEUHFEULNDJNKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19F2N3S/c1-18-4-5-19-8-13(18)12(17-16)7-9-6-10(14)2-3-11(9)15/h2-3,6,12-13,17H,4-5,7-8,16H2,1H3.
What are the key properties of [2-(2,5-difluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine?
[2-(2,5-difluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine has a molecular weight of 287.38 g/mol, XLogP of 1.39, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,5-difluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine is sourced from PubChem (CID 106446251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).