3-[2-(2-fluorophenyl)sulfanyl-1-hydrazinylethyl]-5-methylpyridin-2-amine

C14H17FN4S — CID 105236310

IUPAC3-[2-(2-fluorophenyl)sulfanyl-1-hydrazinylethyl]-5-methylpyridin-2-amine
SMILESCc1cnc(N)c(C(CSc2ccccc2F)NN)c1
InChIInChI=1S/C14H17FN4S/c1-9-6-10(14(16)18-7-9)12(19-17)8-20-13-5-3-2-4-11(13)15/h2-7,12,19H,8,17H2,1H3,(H2,16,18)
InChIKeyJBQWZNGKNXVSRP-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.41
Rot. Bonds5

About 3-[2-(2-fluorophenyl)sulfanyl-1-hydrazinylethyl]-5-methylpyridin-2-amine

3-[2-(2-fluorophenyl)sulfanyl-1-hydrazinylethyl]-5-methylpyridin-2-amine (PubChem CID 105236310) has the molecular formula C14H17FN4S and a molecular weight of 292.38 g/mol. Its IUPAC name is 3-[2-(2-fluorophenyl)sulfanyl-1-hydrazinylethyl]-5-methylpyridin-2-amine.

Molecular Properties

Compound Name3-[2-(2-fluorophenyl)sulfanyl-1-hydrazinylethyl]-5-methylpyridin-2-amine
PubChem CID105236310
Molecular FormulaC14H17FN4S
Molecular Weight292.38 g/mol
Exact Mass292.12
IUPAC Name3-[2-(2-fluorophenyl)sulfanyl-1-hydrazinylethyl]-5-methylpyridin-2-amine
SMILESCc1cnc(N)c(C(CSc2ccccc2F)NN)c1
InChIInChI=1S/C14H17FN4S/c1-9-6-10(14(16)18-7-9)12(19-17)8-20-13-5-3-2-4-11(13)15/h2-7,12,19H,8,17H2,1H3,(H2,16,18)
InChIKeyJBQWZNGKNXVSRP-UHFFFAOYSA-N
XLogP2.41
TPSA76.96 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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

[1-(2,5-dimethylphenyl)-2-(2-fluorophenyl)sulfanylethyl]hydrazine
CID 105236186
[2-(2-fluorophenyl)sulfanyl-1-(6-methyl-3-pyridinyl)ethyl]hydrazine
CID 105236220
3-[(2-fluorophenyl)-hydrazinylmethyl]-5-methylpyridin-2-amine
CID 105216979
3-(1-hydrazinylpropyl)-5-methylpyridin-2-amine
CID 105201163
[2-(2-fluorophenyl)sulfanyl-1-(2,3,4-trifluorophenyl)ethyl]hydrazine
CID 105236101
3-(1-hydrazinylbutyl)-5-methylpyridin-2-amine
CID 105202307
3-[2-(3-chloro-2-fluorophenyl)-1-hydrazinylethyl]-5-methylpyridin-2-amine
CID 105264497
[1-(3-bromo-2-fluorophenyl)-2-(2-fluorophenyl)sulfanylethyl]hydrazine
CID 106649115
3-[2-(3-chlorophenyl)-1-hydrazinylethyl]-5-methylpyridin-2-amine
CID 105195089
1-(2,5-dimethylphenyl)-N-ethyl-2-(2-fluorophenyl)sulfanylethanamine
CID 64620085
3-(1-hydrazinyl-2-propoxyethyl)-5-methylpyridin-2-amine
CID 105210168
[1-(5-fluoro-2-methylphenyl)-2-(2-methylphenyl)sulfanylethyl]hydrazine
CID 105237339

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-fluorophenyl)sulfanyl-1-hydrazinylethyl]-5-methylpyridin-2-amine?
The IUPAC name of 3-[2-(2-fluorophenyl)sulfanyl-1-hydrazinylethyl]-5-methylpyridin-2-amine (CID 105236310) is 3-[2-(2-fluorophenyl)sulfanyl-1-hydrazinylethyl]-5-methylpyridin-2-amine.
What is the SMILES notation for 3-[2-(2-fluorophenyl)sulfanyl-1-hydrazinylethyl]-5-methylpyridin-2-amine?
The canonical SMILES for 3-[2-(2-fluorophenyl)sulfanyl-1-hydrazinylethyl]-5-methylpyridin-2-amine is Cc1cnc(N)c(C(CSc2ccccc2F)NN)c1.
What is the InChIKey of 3-[2-(2-fluorophenyl)sulfanyl-1-hydrazinylethyl]-5-methylpyridin-2-amine?
The InChIKey is JBQWZNGKNXVSRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN4S/c1-9-6-10(14(16)18-7-9)12(19-17)8-20-13-5-3-2-4-11(13)15/h2-7,12,19H,8,17H2,1H3,(H2,16,18).
What are the key properties of 3-[2-(2-fluorophenyl)sulfanyl-1-hydrazinylethyl]-5-methylpyridin-2-amine?
3-[2-(2-fluorophenyl)sulfanyl-1-hydrazinylethyl]-5-methylpyridin-2-amine has a molecular weight of 292.38 g/mol, XLogP of 2.41, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-fluorophenyl)sulfanyl-1-hydrazinylethyl]-5-methylpyridin-2-amine is sourced from PubChem (CID 105236310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).