N-benzyl-1,2,3,4-tetrahydroacridin-9-amine

C20H20N2 — CID 1933

IUPACN-benzyl-1,2,3,4-tetrahydroacridin-9-amine
SMILESc1ccc(CNc2c3c(nc4ccccc24)CCCC3)cc1
InChIInChI=1S/C20H20N2/c1-2-8-15(9-3-1)14-21-20-16-10-4-6-12-18(16)22-19-13-7-5-11-17(19)20/h1-4,6,8-10,12H,5,7,11,13-14H2,(H,21,22)
InChIKeyJYJAEHAURXXPSD-UHFFFAOYSA-N
MW288.39 g/mol
LogP4.73
Rot. Bonds3

About N-benzyl-1,2,3,4-tetrahydroacridin-9-amine

N-benzyl-1,2,3,4-tetrahydroacridin-9-amine (PubChem CID 1933) has the molecular formula C20H20N2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-benzyl-1,2,3,4-tetrahydroacridin-9-amine.

Molecular Properties

Compound NameN-benzyl-1,2,3,4-tetrahydroacridin-9-amine
PubChem CID1933
Molecular FormulaC20H20N2
Molecular Weight288.39 g/mol
Exact Mass288.16
IUPAC NameN-benzyl-1,2,3,4-tetrahydroacridin-9-amine
SMILESc1ccc(CNc2c3c(nc4ccccc24)CCCC3)cc1
InChIInChI=1S/C20H20N2/c1-2-8-15(9-3-1)14-21-20-16-10-4-6-12-18(16)22-19-13-7-5-11-17(19)20/h1-4,6,8-10,12H,5,7,11,13-14H2,(H,21,22)
InChIKeyJYJAEHAURXXPSD-UHFFFAOYSA-N
XLogP4.73
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-benzyl-1,2,3,4-tetrahydroacridin-9-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Tacrine
CID 1935
Dequalinium Chloride
CID 10649
Proflavine
CID 7099
Acridine
CID 9215
Acridine Orange Base
CID 62344
Acriflavine
CID 443101
Dequalinium
CID 2993
Tacrine Hydrochloride
CID 2723754
9-Aminoacridine
CID 7019
Ethidium Bromide
CID 14710
9-Aminoacridine hydrochloride
CID 8643
Nitracrine
CID 20628

Frequently Asked Questions

What is the IUPAC name of N-benzyl-1,2,3,4-tetrahydroacridin-9-amine?
The IUPAC name of N-benzyl-1,2,3,4-tetrahydroacridin-9-amine (CID 1933) is N-benzyl-1,2,3,4-tetrahydroacridin-9-amine.
What is the SMILES notation for N-benzyl-1,2,3,4-tetrahydroacridin-9-amine?
The canonical SMILES for N-benzyl-1,2,3,4-tetrahydroacridin-9-amine is c1ccc(CNc2c3c(nc4ccccc24)CCCC3)cc1.
What is the InChIKey of N-benzyl-1,2,3,4-tetrahydroacridin-9-amine?
The InChIKey is JYJAEHAURXXPSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2/c1-2-8-15(9-3-1)14-21-20-16-10-4-6-12-18(16)22-19-13-7-5-11-17(19)20/h1-4,6,8-10,12H,5,7,11,13-14H2,(H,21,22).
What are the key properties of N-benzyl-1,2,3,4-tetrahydroacridin-9-amine?
N-benzyl-1,2,3,4-tetrahydroacridin-9-amine has a molecular weight of 288.39 g/mol, XLogP of 4.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-1,2,3,4-tetrahydroacridin-9-amine is sourced from PubChem (CID 1933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).