4-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine

C19H19F2N5O2 — CID 126680575

IUPAC4-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
SMILESCOc1ccccc1-c1ccc(F)c(COc2cc(N)nc(NN)c2N)c1F
InChIInChI=1S/C19H19F2N5O2/c1-27-14-5-3-2-4-10(14)11-6-7-13(20)12(17(11)21)9-28-15-8-16(22)25-19(26-24)18(15)23/h2-8H,9,23-24H2,1H3,(H3,22,25,26)
InChIKeyPZSXZBCDQGNWGS-UHFFFAOYSA-N
MW387.39 g/mol
LogP3.06
Rot. Bonds6

About 4-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine

4-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine (PubChem CID 126680575) has the molecular formula C19H19F2N5O2 and a molecular weight of 387.39 g/mol. Its IUPAC name is 4-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine.

Molecular Properties

Compound Name4-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
PubChem CID126680575
Molecular FormulaC19H19F2N5O2
Molecular Weight387.39 g/mol
Exact Mass387.15
IUPAC Name4-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
SMILESCOc1ccccc1-c1ccc(F)c(COc2cc(N)nc(NN)c2N)c1F
InChIInChI=1S/C19H19F2N5O2/c1-27-14-5-3-2-4-10(14)11-6-7-13(20)12(17(11)21)9-28-15-8-16(22)25-19(26-24)18(15)23/h2-8H,9,23-24H2,1H3,(H3,22,25,26)
InChIKeyPZSXZBCDQGNWGS-UHFFFAOYSA-N
XLogP3.06
TPSA121.44 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.39
LogP ≤ 53.06
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

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

7-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126648804
4-[[3-(2-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678935
4-[(5-bromo-2-methoxyphenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678860
4-[[2-fluoro-5-(pentafluoro-λ6-sulfanyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126680585
2,3-difluoro-1,4-bis(2-methoxyphenyl)benzene
CID 58004087
methyl 3-[(3,6-diamino-2-hydrazinyl-4-pyridinyl)oxymethyl]benzoate
CID 126680550
4-[[5-(3-fluorophenyl)-2-methylphenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678926
1,2-difluoro-3-(2-methoxyphenyl)benzene
CID 57230342
3-fluoro-4-(2-methoxyphenyl)phenol
CID 53219300
[3-fluoro-4-(2-methoxyphenyl)phenyl]methanamine
CID 81446738
6-(2-fluoro-3-methoxyphenyl)-2-methylpyrimidin-4-amine
CID 82811355
2-chloro-5-[(2-fluoro-6-methoxyphenyl)methoxy]-4-methoxyaniline
CID 59309657

Frequently Asked Questions

What is the IUPAC name of 4-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine?
The IUPAC name of 4-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine (CID 126680575) is 4-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine.
What is the SMILES notation for 4-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine?
The canonical SMILES for 4-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine is COc1ccccc1-c1ccc(F)c(COc2cc(N)nc(NN)c2N)c1F.
What is the InChIKey of 4-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine?
The InChIKey is PZSXZBCDQGNWGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F2N5O2/c1-27-14-5-3-2-4-10(14)11-6-7-13(20)12(17(11)21)9-28-15-8-16(22)25-19(26-24)18(15)23/h2-8H,9,23-24H2,1H3,(H3,22,25,26).
What are the key properties of 4-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine?
4-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine has a molecular weight of 387.39 g/mol, XLogP of 3.06, 6 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine is sourced from PubChem (CID 126680575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).