4-[(2,3-difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine

C12H13F2N5O — CID 126678944

IUPAC4-[(2,3-difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine
SMILESNNc1nc(N)cc(OCc2cccc(F)c2F)c1N
InChIInChI=1S/C12H13F2N5O/c13-7-3-1-2-6(10(7)14)5-20-8-4-9(15)18-12(19-17)11(8)16/h1-4H,5,16-17H2,(H3,15,18,19)
InChIKeyWSZHILLWIZRLLY-UHFFFAOYSA-N
MW281.27 g/mol
LogP1.39
Rot. Bonds4

About 4-[(2,3-difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine

4-[(2,3-difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine (PubChem CID 126678944) has the molecular formula C12H13F2N5O and a molecular weight of 281.27 g/mol. Its IUPAC name is 4-[(2,3-difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine.

Molecular Properties

Compound Name4-[(2,3-difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine
PubChem CID126678944
Molecular FormulaC12H13F2N5O
Molecular Weight281.27 g/mol
Exact Mass281.11
IUPAC Name4-[(2,3-difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine
SMILESNNc1nc(N)cc(OCc2cccc(F)c2F)c1N
InChIInChI=1S/C12H13F2N5O/c13-7-3-1-2-6(10(7)14)5-20-8-4-9(15)18-12(19-17)11(8)16/h1-4H,5,16-17H2,(H3,15,18,19)
InChIKeyWSZHILLWIZRLLY-UHFFFAOYSA-N
XLogP1.39
TPSA112.21 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.27
LogP ≤ 51.39
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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

Agn-PC-0nhor0
CID 12069799
2-Hydrazino-6-(4-trifluoromethylphenoxy)pyridine
CID 18544786
(4-Benzyloxy-3-trifluoromethyl-pyridin-2-yl)-hydrazine
CID 57459602
[4-[2-(2,6-Difluorophenyl)ethoxy]-3-(trifluoromethyl)pyridin-2-yl]hydrazine
CID 117967061
[4-[2-(2,6-Difluorophenyl)ethoxy]-3-methyl-2-pyridinyl]hydrazine
CID 122488710
7-[(2,4-difluorophenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126648882
3-[(4-Chlorophenyl)diazenyl]-4-(2,2,2-trifluoro-1-phenylethoxy)pyridine-2,6-diamine
CID 126649083
7-[(2,3-difluorophenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126649109
7-[(2,6-difluorophenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126678663
4-[(2,6-Difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678665
6-Hydrazinyl-4-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]pyridine-2,5-diamine
CID 126678773
6-Hydrazinyl-4-[[2-methoxy-5-(trifluoromethoxy)phenyl]methoxy]pyridine-2,5-diamine
CID 126678774

Frequently Asked Questions

What is the IUPAC name of 4-[(2,3-difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine?
The IUPAC name of 4-[(2,3-difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine (CID 126678944) is 4-[(2,3-difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine.
What is the SMILES notation for 4-[(2,3-difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine?
The canonical SMILES for 4-[(2,3-difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine is NNc1nc(N)cc(OCc2cccc(F)c2F)c1N.
What is the InChIKey of 4-[(2,3-difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine?
The InChIKey is WSZHILLWIZRLLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13F2N5O/c13-7-3-1-2-6(10(7)14)5-20-8-4-9(15)18-12(19-17)11(8)16/h1-4H,5,16-17H2,(H3,15,18,19).
What are the key properties of 4-[(2,3-difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine?
4-[(2,3-difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine has a molecular weight of 281.27 g/mol, XLogP of 1.39, 4 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,3-difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine is sourced from PubChem (CID 126678944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).