6-hydrazinyl-4-[[2-methoxy-5-(trifluoromethoxy)phenyl]methoxy]pyridine-2,5-diamine

C14H16F3N5O3 — CID 126678774

IUPAC6-hydrazinyl-4-[[2-methoxy-5-(trifluoromethoxy)phenyl]methoxy]pyridine-2,5-diamine
SMILESCOc1ccc(OC(F)(F)F)cc1COc1cc(N)nc(NN)c1N
InChIInChI=1S/C14H16F3N5O3/c1-23-9-3-2-8(25-14(15,16)17)4-7(9)6-24-10-5-11(18)21-13(22-20)12(10)19/h2-5H,6,19-20H2,1H3,(H3,18,21,22)
InChIKeyXZFMUJWSJYXQDE-UHFFFAOYSA-N
MW359.31 g/mol
LogP2.02
Rot. Bonds6

About 6-hydrazinyl-4-[[2-methoxy-5-(trifluoromethoxy)phenyl]methoxy]pyridine-2,5-diamine

6-hydrazinyl-4-[[2-methoxy-5-(trifluoromethoxy)phenyl]methoxy]pyridine-2,5-diamine (PubChem CID 126678774) has the molecular formula C14H16F3N5O3 and a molecular weight of 359.31 g/mol. Its IUPAC name is 6-hydrazinyl-4-[[2-methoxy-5-(trifluoromethoxy)phenyl]methoxy]pyridine-2,5-diamine.

Molecular Properties

Compound Name6-hydrazinyl-4-[[2-methoxy-5-(trifluoromethoxy)phenyl]methoxy]pyridine-2,5-diamine
PubChem CID126678774
Molecular FormulaC14H16F3N5O3
Molecular Weight359.31 g/mol
Exact Mass359.12
IUPAC Name6-hydrazinyl-4-[[2-methoxy-5-(trifluoromethoxy)phenyl]methoxy]pyridine-2,5-diamine
SMILESCOc1ccc(OC(F)(F)F)cc1COc1cc(N)nc(NN)c1N
InChIInChI=1S/C14H16F3N5O3/c1-23-9-3-2-8(25-14(15,16)17)4-7(9)6-24-10-5-11(18)21-13(22-20)12(10)19/h2-5H,6,19-20H2,1H3,(H3,18,21,22)
InChIKeyXZFMUJWSJYXQDE-UHFFFAOYSA-N
XLogP2.02
TPSA130.67 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.31
LogP ≤ 52.02
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

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-methoxy-5-(trifluoromethoxy)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126648720
4-[[2-(Trifluoromethoxy)phenyl]methoxy]pyridine-2,6-diamine
CID 126648938
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
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
4-[[3-(3-Fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678820
4-[(3-Bromo-2-fluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678826
6-Hydrazinyl-4-[[2-methoxy-5-(trifluoromethyl)phenyl]methoxy]pyridine-2,5-diamine
CID 126678829
4-[[5-(3-Fluorophenyl)-2-methoxyphenyl]methoxy]pyridine-2,3,6-triamine
CID 126678849
4-[2,2-Difluoro-1-(2-methoxyphenyl)butoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678850

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-4-[[2-methoxy-5-(trifluoromethoxy)phenyl]methoxy]pyridine-2,5-diamine?
The IUPAC name of 6-hydrazinyl-4-[[2-methoxy-5-(trifluoromethoxy)phenyl]methoxy]pyridine-2,5-diamine (CID 126678774) is 6-hydrazinyl-4-[[2-methoxy-5-(trifluoromethoxy)phenyl]methoxy]pyridine-2,5-diamine.
What is the SMILES notation for 6-hydrazinyl-4-[[2-methoxy-5-(trifluoromethoxy)phenyl]methoxy]pyridine-2,5-diamine?
The canonical SMILES for 6-hydrazinyl-4-[[2-methoxy-5-(trifluoromethoxy)phenyl]methoxy]pyridine-2,5-diamine is COc1ccc(OC(F)(F)F)cc1COc1cc(N)nc(NN)c1N.
What is the InChIKey of 6-hydrazinyl-4-[[2-methoxy-5-(trifluoromethoxy)phenyl]methoxy]pyridine-2,5-diamine?
The InChIKey is XZFMUJWSJYXQDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16F3N5O3/c1-23-9-3-2-8(25-14(15,16)17)4-7(9)6-24-10-5-11(18)21-13(22-20)12(10)19/h2-5H,6,19-20H2,1H3,(H3,18,21,22).
What are the key properties of 6-hydrazinyl-4-[[2-methoxy-5-(trifluoromethoxy)phenyl]methoxy]pyridine-2,5-diamine?
6-hydrazinyl-4-[[2-methoxy-5-(trifluoromethoxy)phenyl]methoxy]pyridine-2,5-diamine has a molecular weight of 359.31 g/mol, XLogP of 2.02, 6 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-4-[[2-methoxy-5-(trifluoromethoxy)phenyl]methoxy]pyridine-2,5-diamine is sourced from PubChem (CID 126678774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).