(8-chloro-6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine

C13H13ClFN3 — CID 107370632

IUPAC(8-chloro-6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine
SMILESNNc1c2c(nc3cc(F)cc(Cl)c13)CCCC2
InChIInChI=1S/C13H13ClFN3/c14-9-5-7(15)6-11-12(9)13(18-16)8-3-1-2-4-10(8)17-11/h5-6H,1-4,16H2,(H,17,18)
InChIKeyMAXYVIMDJPYXEY-UHFFFAOYSA-N
MW265.72 g/mol
LogP3.19
Rot. Bonds1

About (8-chloro-6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine

(8-chloro-6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine (PubChem CID 107370632) has the molecular formula C13H13ClFN3 and a molecular weight of 265.72 g/mol. Its IUPAC name is (8-chloro-6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine.

Molecular Properties

Compound Name(8-chloro-6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine
PubChem CID107370632
Molecular FormulaC13H13ClFN3
Molecular Weight265.72 g/mol
Exact Mass265.08
IUPAC Name(8-chloro-6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine
SMILESNNc1c2c(nc3cc(F)cc(Cl)c13)CCCC2
InChIInChI=1S/C13H13ClFN3/c14-9-5-7(15)6-11-12(9)13(18-16)8-3-1-2-4-10(8)17-11/h5-6H,1-4,16H2,(H,17,18)
InChIKeyMAXYVIMDJPYXEY-UHFFFAOYSA-N
XLogP3.19
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.72
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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 (8-chloro-6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine?
The IUPAC name of (8-chloro-6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine (CID 107370632) is (8-chloro-6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine.
What is the SMILES notation for (8-chloro-6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine?
The canonical SMILES for (8-chloro-6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine is NNc1c2c(nc3cc(F)cc(Cl)c13)CCCC2.
What is the InChIKey of (8-chloro-6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine?
The InChIKey is MAXYVIMDJPYXEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClFN3/c14-9-5-7(15)6-11-12(9)13(18-16)8-3-1-2-4-10(8)17-11/h5-6H,1-4,16H2,(H,17,18).
What are the key properties of (8-chloro-6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine?
(8-chloro-6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine has a molecular weight of 265.72 g/mol, XLogP of 3.19, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8-chloro-6-fluoro-1,2,3,4-tetrahydroacridin-9-yl)hydrazine is sourced from PubChem (CID 107370632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).