7-bromo-5-ethyl-1,2,3,4-tetrahydroacridin-9-amine

C15H17BrN2 — CID 81289505

IUPAC7-bromo-5-ethyl-1,2,3,4-tetrahydroacridin-9-amine
SMILESCCc1cc(Br)cc2c(N)c3c(nc12)CCCC3
InChIInChI=1S/C15H17BrN2/c1-2-9-7-10(16)8-12-14(17)11-5-3-4-6-13(11)18-15(9)12/h7-8H,2-6H2,1H3,(H2,17,18)
InChIKeySRVBOVLRXQRGJB-UHFFFAOYSA-N
MW305.22 g/mol
LogP4.02
Rot. Bonds1

About 7-bromo-5-ethyl-1,2,3,4-tetrahydroacridin-9-amine

7-bromo-5-ethyl-1,2,3,4-tetrahydroacridin-9-amine (PubChem CID 81289505) has the molecular formula C15H17BrN2 and a molecular weight of 305.22 g/mol. Its IUPAC name is 7-bromo-5-ethyl-1,2,3,4-tetrahydroacridin-9-amine.

Molecular Properties

Compound Name7-bromo-5-ethyl-1,2,3,4-tetrahydroacridin-9-amine
PubChem CID81289505
Molecular FormulaC15H17BrN2
Molecular Weight305.22 g/mol
Exact Mass304.06
IUPAC Name7-bromo-5-ethyl-1,2,3,4-tetrahydroacridin-9-amine
SMILESCCc1cc(Br)cc2c(N)c3c(nc12)CCCC3
InChIInChI=1S/C15H17BrN2/c1-2-9-7-10(16)8-12-14(17)11-5-3-4-6-13(11)18-15(9)12/h7-8H,2-6H2,1H3,(H2,17,18)
InChIKeySRVBOVLRXQRGJB-UHFFFAOYSA-N
XLogP4.02
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.22
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 7-bromo-5-ethyl-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

Frequently Asked Questions

What is the IUPAC name of 7-bromo-5-ethyl-1,2,3,4-tetrahydroacridin-9-amine?
The IUPAC name of 7-bromo-5-ethyl-1,2,3,4-tetrahydroacridin-9-amine (CID 81289505) is 7-bromo-5-ethyl-1,2,3,4-tetrahydroacridin-9-amine.
What is the SMILES notation for 7-bromo-5-ethyl-1,2,3,4-tetrahydroacridin-9-amine?
The canonical SMILES for 7-bromo-5-ethyl-1,2,3,4-tetrahydroacridin-9-amine is CCc1cc(Br)cc2c(N)c3c(nc12)CCCC3.
What is the InChIKey of 7-bromo-5-ethyl-1,2,3,4-tetrahydroacridin-9-amine?
The InChIKey is SRVBOVLRXQRGJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrN2/c1-2-9-7-10(16)8-12-14(17)11-5-3-4-6-13(11)18-15(9)12/h7-8H,2-6H2,1H3,(H2,17,18).
What are the key properties of 7-bromo-5-ethyl-1,2,3,4-tetrahydroacridin-9-amine?
7-bromo-5-ethyl-1,2,3,4-tetrahydroacridin-9-amine has a molecular weight of 305.22 g/mol, XLogP of 4.02, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-5-ethyl-1,2,3,4-tetrahydroacridin-9-amine is sourced from PubChem (CID 81289505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).