3-[2-(2-fluoro-6-methoxyphenyl)-2-hydrazinylethyl]pyridin-4-amine

C14H17FN4O — CID 105252589

IUPAC3-[2-(2-fluoro-6-methoxyphenyl)-2-hydrazinylethyl]pyridin-4-amine
SMILESCOc1cccc(F)c1C(Cc1cnccc1N)NN
InChIInChI=1S/C14H17FN4O/c1-20-13-4-2-3-10(15)14(13)12(19-17)7-9-8-18-6-5-11(9)16/h2-6,8,12,19H,7,17H2,1H3,(H2,16,18)
InChIKeyIRQLSSSTMGICBM-UHFFFAOYSA-N
MW276.32 g/mol
LogP1.56
Rot. Bonds5

About 3-[2-(2-fluoro-6-methoxyphenyl)-2-hydrazinylethyl]pyridin-4-amine

3-[2-(2-fluoro-6-methoxyphenyl)-2-hydrazinylethyl]pyridin-4-amine (PubChem CID 105252589) has the molecular formula C14H17FN4O and a molecular weight of 276.32 g/mol. Its IUPAC name is 3-[2-(2-fluoro-6-methoxyphenyl)-2-hydrazinylethyl]pyridin-4-amine.

Molecular Properties

Compound Name3-[2-(2-fluoro-6-methoxyphenyl)-2-hydrazinylethyl]pyridin-4-amine
PubChem CID105252589
Molecular FormulaC14H17FN4O
Molecular Weight276.32 g/mol
Exact Mass276.14
IUPAC Name3-[2-(2-fluoro-6-methoxyphenyl)-2-hydrazinylethyl]pyridin-4-amine
SMILESCOc1cccc(F)c1C(Cc1cnccc1N)NN
InChIInChI=1S/C14H17FN4O/c1-20-13-4-2-3-10(15)14(13)12(19-17)7-9-8-18-6-5-11(9)16/h2-6,8,12,19H,7,17H2,1H3,(H2,16,18)
InChIKeyIRQLSSSTMGICBM-UHFFFAOYSA-N
XLogP1.56
TPSA86.19 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.32
LogP ≤ 51.56
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

3-[2-hydrazinyl-2-(4-methoxyphenyl)ethyl]pyridin-4-amine
CID 105191007
[2-(2-chloro-6-fluorophenyl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine
CID 105252351
[2-(2-bromo-3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine
CID 105327156
[1-(2-fluoro-6-methoxyphenyl)-4,4-dimethylpentyl]hydrazine
CID 105252498
[2-(3,4-dimethylphenyl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine
CID 105252484
[2-(4-chloro-3-fluorophenyl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine
CID 107895230
[2-(2,5-dimethylpyrazol-3-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine
CID 105252504
[2-(4-bromothiophen-2-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine
CID 105252540
[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine
CID 105252566
[1-(2-fluoro-6-methoxyphenyl)-3-(1-methylimidazol-2-yl)propyl]hydrazine
CID 105252516
3-(2-hydrazinyl-3-methylbutyl)pyridin-4-amine
CID 105199730
1-(2-fluoro-6-methoxyphenyl)-N-(pyridin-4-ylmethyl)ethanamine
CID 112695110

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-fluoro-6-methoxyphenyl)-2-hydrazinylethyl]pyridin-4-amine?
The IUPAC name of 3-[2-(2-fluoro-6-methoxyphenyl)-2-hydrazinylethyl]pyridin-4-amine (CID 105252589) is 3-[2-(2-fluoro-6-methoxyphenyl)-2-hydrazinylethyl]pyridin-4-amine.
What is the SMILES notation for 3-[2-(2-fluoro-6-methoxyphenyl)-2-hydrazinylethyl]pyridin-4-amine?
The canonical SMILES for 3-[2-(2-fluoro-6-methoxyphenyl)-2-hydrazinylethyl]pyridin-4-amine is COc1cccc(F)c1C(Cc1cnccc1N)NN.
What is the InChIKey of 3-[2-(2-fluoro-6-methoxyphenyl)-2-hydrazinylethyl]pyridin-4-amine?
The InChIKey is IRQLSSSTMGICBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN4O/c1-20-13-4-2-3-10(15)14(13)12(19-17)7-9-8-18-6-5-11(9)16/h2-6,8,12,19H,7,17H2,1H3,(H2,16,18).
What are the key properties of 3-[2-(2-fluoro-6-methoxyphenyl)-2-hydrazinylethyl]pyridin-4-amine?
3-[2-(2-fluoro-6-methoxyphenyl)-2-hydrazinylethyl]pyridin-4-amine has a molecular weight of 276.32 g/mol, XLogP of 1.56, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-fluoro-6-methoxyphenyl)-2-hydrazinylethyl]pyridin-4-amine is sourced from PubChem (CID 105252589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).