(5,6,8-trifluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine

C13H12F3N3 — CID 62812081

IUPAC(5,6,8-trifluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine
SMILESNNc1c2c(nc3c(F)c(F)cc(F)c13)CCCC2
InChIInChI=1S/C13H12F3N3/c14-7-5-8(15)11(16)13-10(7)12(19-17)6-3-1-2-4-9(6)18-13/h5H,1-4,17H2,(H,18,19)
InChIKeyZGMVULVJLICKMA-UHFFFAOYSA-N
MW267.25 g/mol
LogP2.82
Rot. Bonds1

About (5,6,8-trifluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine

(5,6,8-trifluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine (PubChem CID 62812081) has the molecular formula C13H12F3N3 and a molecular weight of 267.25 g/mol. Its IUPAC name is (5,6,8-trifluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine.

Molecular Properties

Compound Name(5,6,8-trifluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine
PubChem CID62812081
Molecular FormulaC13H12F3N3
Molecular Weight267.25 g/mol
Exact Mass267.10
IUPAC Name(5,6,8-trifluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine
SMILESNNc1c2c(nc3c(F)c(F)cc(F)c13)CCCC2
InChIInChI=1S/C13H12F3N3/c14-7-5-8(15)11(16)13-10(7)12(19-17)6-3-1-2-4-9(6)18-13/h5H,1-4,17H2,(H,18,19)
InChIKeyZGMVULVJLICKMA-UHFFFAOYSA-N
XLogP2.82
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.25
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', '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 (5,6,8-trifluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine?
The IUPAC name of (5,6,8-trifluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine (CID 62812081) is (5,6,8-trifluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine.
What is the SMILES notation for (5,6,8-trifluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine?
The canonical SMILES for (5,6,8-trifluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine is NNc1c2c(nc3c(F)c(F)cc(F)c13)CCCC2.
What is the InChIKey of (5,6,8-trifluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine?
The InChIKey is ZGMVULVJLICKMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12F3N3/c14-7-5-8(15)11(16)13-10(7)12(19-17)6-3-1-2-4-9(6)18-13/h5H,1-4,17H2,(H,18,19).
What are the key properties of (5,6,8-trifluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine?
(5,6,8-trifluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine has a molecular weight of 267.25 g/mol, XLogP of 2.82, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5,6,8-trifluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine is sourced from PubChem (CID 62812081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).