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

C18H17F2N5O — CID 126679894

IUPAC4-[[2-fluoro-3-(3-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
SMILESNNc1nc(N)cc(OCc2cccc(-c3cccc(F)c3)c2F)c1N
InChIInChI=1S/C18H17F2N5O/c19-12-5-1-3-10(7-12)13-6-2-4-11(16(13)20)9-26-14-8-15(21)24-18(25-23)17(14)22/h1-8H,9,22-23H2,(H3,21,24,25)
InChIKeyYCYHHHUYDCVIPP-UHFFFAOYSA-N
MW357.36 g/mol
LogP3.06
Rot. Bonds5

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

4-[[2-fluoro-3-(3-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine (PubChem CID 126679894) has the molecular formula C18H17F2N5O and a molecular weight of 357.36 g/mol. Its IUPAC name is 4-[[2-fluoro-3-(3-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine.

Molecular Properties

Compound Name4-[[2-fluoro-3-(3-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
PubChem CID126679894
Molecular FormulaC18H17F2N5O
Molecular Weight357.36 g/mol
Exact Mass357.14
IUPAC Name4-[[2-fluoro-3-(3-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
SMILESNNc1nc(N)cc(OCc2cccc(-c3cccc(F)c3)c2F)c1N
InChIInChI=1S/C18H17F2N5O/c19-12-5-1-3-10(7-12)13-6-2-4-11(16(13)20)9-26-14-8-15(21)24-18(25-23)17(14)22/h1-8H,9,22-23H2,(H3,21,24,25)
InChIKeyYCYHHHUYDCVIPP-UHFFFAOYSA-N
XLogP3.06
TPSA112.21 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.36
LogP ≤ 53.06
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

7-[[3-(3-fluorophenyl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126678812
7-[[3-(2-fluorophenyl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126678929
7-[[3-(4-fluorophenyl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126648827
7-[[2-fluoro-5-(3-fluorophenyl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126648897
7-[[2-fluoro-3-(3-fluorophenyl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126649071
3-[(4-Chlorophenyl)diazenyl]-4-(2,2,2-trifluoro-1-phenylethoxy)pyridine-2,6-diamine
CID 126649083
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
7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine
CID 126678778
7-[[4-(difluoromethoxy)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine
CID 126678796
4-[[4-(Difluoromethoxy)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678797

Frequently Asked Questions

What is the IUPAC name of 4-[[2-fluoro-3-(3-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine?
The IUPAC name of 4-[[2-fluoro-3-(3-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine (CID 126679894) is 4-[[2-fluoro-3-(3-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine.
What is the SMILES notation for 4-[[2-fluoro-3-(3-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine?
The canonical SMILES for 4-[[2-fluoro-3-(3-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine is NNc1nc(N)cc(OCc2cccc(-c3cccc(F)c3)c2F)c1N.
What is the InChIKey of 4-[[2-fluoro-3-(3-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine?
The InChIKey is YCYHHHUYDCVIPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17F2N5O/c19-12-5-1-3-10(7-12)13-6-2-4-11(16(13)20)9-26-14-8-15(21)24-18(25-23)17(14)22/h1-8H,9,22-23H2,(H3,21,24,25).
What are the key properties of 4-[[2-fluoro-3-(3-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine?
4-[[2-fluoro-3-(3-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine has a molecular weight of 357.36 g/mol, XLogP of 3.06, 5 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-fluoro-3-(3-fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine is sourced from PubChem (CID 126679894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).