6-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine

C9H13F3N4O — CID 80909686

IUPAC6-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine
SMILESNNc1cccc(NCCOCC(F)(F)F)n1
InChIInChI=1S/C9H13F3N4O/c10-9(11,12)6-17-5-4-14-7-2-1-3-8(15-7)16-13/h1-3H,4-6,13H2,(H2,14,15,16)
InChIKeyUZAYBGNCYQFPBG-UHFFFAOYSA-N
MW250.22 g/mol
LogP1.36
Rot. Bonds6

About 6-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine

6-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine (PubChem CID 80909686) has the molecular formula C9H13F3N4O and a molecular weight of 250.22 g/mol. Its IUPAC name is 6-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine
PubChem CID80909686
Molecular FormulaC9H13F3N4O
Molecular Weight250.22 g/mol
Exact Mass250.10
IUPAC Name6-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine
SMILESNNc1cccc(NCCOCC(F)(F)F)n1
InChIInChI=1S/C9H13F3N4O/c10-9(11,12)6-17-5-4-14-7-2-1-3-8(15-7)16-13/h1-3H,4-6,13H2,(H2,14,15,16)
InChIKeyUZAYBGNCYQFPBG-UHFFFAOYSA-N
XLogP1.36
TPSA72.20 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.22
LogP ≤ 51.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine?
The IUPAC name of 6-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine (CID 80909686) is 6-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine.
What is the SMILES notation for 6-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine?
The canonical SMILES for 6-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine is NNc1cccc(NCCOCC(F)(F)F)n1.
What is the InChIKey of 6-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine?
The InChIKey is UZAYBGNCYQFPBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13F3N4O/c10-9(11,12)6-17-5-4-14-7-2-1-3-8(15-7)16-13/h1-3H,4-6,13H2,(H2,14,15,16).
What are the key properties of 6-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine?
6-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine has a molecular weight of 250.22 g/mol, XLogP of 1.36, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine is sourced from PubChem (CID 80909686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).