8-fluoro-1,2,3,4-tetrahydroacridin-9-amine

C13H13FN2 — CID 19770286

IUPAC8-fluoro-1,2,3,4-tetrahydroacridin-9-amine
SMILESNc1c2c(nc3cccc(F)c13)CCCC2
InChIInChI=1S/C13H13FN2/c14-9-5-3-7-11-12(9)13(15)8-4-1-2-6-10(8)16-11/h3,5,7H,1-2,4,6H2,(H2,15,16)
InChIKeyPADRKJUJDBXCPM-UHFFFAOYSA-N
MW216.26 g/mol
LogP2.83
Rot. Bonds

About 8-fluoro-1,2,3,4-tetrahydroacridin-9-amine

8-fluoro-1,2,3,4-tetrahydroacridin-9-amine (PubChem CID 19770286) has the molecular formula C13H13FN2 and a molecular weight of 216.26 g/mol. Its IUPAC name is 8-fluoro-1,2,3,4-tetrahydroacridin-9-amine.

Molecular Properties

Compound Name8-fluoro-1,2,3,4-tetrahydroacridin-9-amine
PubChem CID19770286
Molecular FormulaC13H13FN2
Molecular Weight216.26 g/mol
Exact Mass216.11
IUPAC Name8-fluoro-1,2,3,4-tetrahydroacridin-9-amine
SMILESNc1c2c(nc3cccc(F)c13)CCCC2
InChIInChI=1S/C13H13FN2/c14-9-5-3-7-11-12(9)13(15)8-4-1-2-6-10(8)16-11/h3,5,7H,1-2,4,6H2,(H2,15,16)
InChIKeyPADRKJUJDBXCPM-UHFFFAOYSA-N
XLogP2.83
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.26
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-fluoro-1,2,3,4-tetrahydroacridin-9-amine?
The IUPAC name of 8-fluoro-1,2,3,4-tetrahydroacridin-9-amine (CID 19770286) is 8-fluoro-1,2,3,4-tetrahydroacridin-9-amine.
What is the SMILES notation for 8-fluoro-1,2,3,4-tetrahydroacridin-9-amine?
The canonical SMILES for 8-fluoro-1,2,3,4-tetrahydroacridin-9-amine is Nc1c2c(nc3cccc(F)c13)CCCC2.
What is the InChIKey of 8-fluoro-1,2,3,4-tetrahydroacridin-9-amine?
The InChIKey is PADRKJUJDBXCPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN2/c14-9-5-3-7-11-12(9)13(15)8-4-1-2-6-10(8)16-11/h3,5,7H,1-2,4,6H2,(H2,15,16).
What are the key properties of 8-fluoro-1,2,3,4-tetrahydroacridin-9-amine?
8-fluoro-1,2,3,4-tetrahydroacridin-9-amine has a molecular weight of 216.26 g/mol, XLogP of 2.83, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-1,2,3,4-tetrahydroacridin-9-amine is sourced from PubChem (CID 19770286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).