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

C18H18FN5O — CID 126678935

IUPAC4-[[3-(2-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
SMILESNNc1nc(N)cc(OCc2cccc(-c3ccccc3F)c2)c1N
InChIInChI=1S/C18H18FN5O/c19-14-7-2-1-6-13(14)12-5-3-4-11(8-12)10-25-15-9-16(20)23-18(24-22)17(15)21/h1-9H,10,21-22H2,(H3,20,23,24)
InChIKeyISXIJHLZZUVBGM-UHFFFAOYSA-N
MW339.37 g/mol
LogP2.92
Rot. Bonds5

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

4-[[3-(2-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine (PubChem CID 126678935) has the molecular formula C18H18FN5O and a molecular weight of 339.37 g/mol. Its IUPAC name is 4-[[3-(2-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine.

Molecular Properties

Compound Name4-[[3-(2-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
PubChem CID126678935
Molecular FormulaC18H18FN5O
Molecular Weight339.37 g/mol
Exact Mass339.15
IUPAC Name4-[[3-(2-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
SMILESNNc1nc(N)cc(OCc2cccc(-c3ccccc3F)c2)c1N
InChIInChI=1S/C18H18FN5O/c19-14-7-2-1-6-13(14)12-5-3-4-11(8-12)10-25-15-9-16(20)23-18(24-22)17(15)21/h1-9H,10,21-22H2,(H3,20,23,24)
InChIKeyISXIJHLZZUVBGM-UHFFFAOYSA-N
XLogP2.92
TPSA112.21 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.37
LogP ≤ 52.92
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

methyl 3-[(3,6-diamino-2-hydrazinyl-4-pyridinyl)oxymethyl]benzoate
CID 126680550
4-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126680575
4-[[5-(3-fluorophenyl)-2-methylphenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678926
4-[[2-fluoro-5-(pentafluoro-λ6-sulfanyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126680585
4-[[4-(difluoromethoxy)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678797
4-(2-fluorophenyl)-2-phenylmethoxyaniline
CID 171921752
7-[[3-(2-chlorophenyl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126648893
4-phenylmethoxypyridine-2,3,6-triamine;dihydrochloride
CID 131854935
4-[[3-(2-methylpyrazol-3-yl)phenyl]methoxy]pyridine-2,3,6-triamine
CID 126678943
5-[3-[(2,3-difluorophenoxy)methyl]phenyl]-2H-triazole-4-carboxamide
CID 169402724
4-[(3-fluorophenyl)methyl]-6-hydrazinylpyridine-2,5-diamine
CID 130451115
7-[[3-(4-phenylphenyl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126649018

Frequently Asked Questions

What is the IUPAC name of 4-[[3-(2-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine?
The IUPAC name of 4-[[3-(2-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine (CID 126678935) is 4-[[3-(2-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine.
What is the SMILES notation for 4-[[3-(2-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine?
The canonical SMILES for 4-[[3-(2-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine is NNc1nc(N)cc(OCc2cccc(-c3ccccc3F)c2)c1N.
What is the InChIKey of 4-[[3-(2-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine?
The InChIKey is ISXIJHLZZUVBGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FN5O/c19-14-7-2-1-6-13(14)12-5-3-4-11(8-12)10-25-15-9-16(20)23-18(24-22)17(15)21/h1-9H,10,21-22H2,(H3,20,23,24).
What are the key properties of 4-[[3-(2-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine?
4-[[3-(2-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine has a molecular weight of 339.37 g/mol, XLogP of 2.92, 5 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[3-(2-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine is sourced from PubChem (CID 126678935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).