8-chloro-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride

C13H14Cl2N2 — CID 164623616

IUPAC8-chloro-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride
SMILESCl.Nc1c2c(nc3cccc(Cl)c13)CCCC2
InChIInChI=1S/C13H13ClN2.ClH/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);1H
InChIKeyYTBDDSDAOSLSRX-UHFFFAOYSA-N
MW269.17 g/mol
LogP3.77
Rot. Bonds

About 8-chloro-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride

8-chloro-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride (PubChem CID 164623616) has the molecular formula C13H14Cl2N2 and a molecular weight of 269.17 g/mol. Its IUPAC name is 8-chloro-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride.

Molecular Properties

Compound Name8-chloro-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride
PubChem CID164623616
Molecular FormulaC13H14Cl2N2
Molecular Weight269.17 g/mol
Exact Mass268.05
IUPAC Name8-chloro-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride
SMILESCl.Nc1c2c(nc3cccc(Cl)c13)CCCC2
InChIInChI=1S/C13H13ClN2.ClH/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);1H
InChIKeyYTBDDSDAOSLSRX-UHFFFAOYSA-N
XLogP3.77
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.17
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Tacrine
CID 1935
Proflavine
CID 7099
Tacrine Hydrochloride
CID 2723754
9-Aminoacridine
CID 7019
9-Aminoacridine hydrochloride
CID 8643
4-Amino-2-methylquinoline
CID 81116
3,6-Acridinediamine, hydrochloride (1:1)
CID 197873
Aminoquinol
CID 5708341
1-Acridinamine
CID 11352
Acridine, 1,2,3,4-tetrahydro-9-amino-7-chloro-
CID 22493
4-Amino-7-chloroquinoline
CID 94711
1,2,3,4-Tetrahydro-9-acridinamine hydrochloride hydrate (1:?:?)
CID 6420002

Frequently Asked Questions

What is the IUPAC name of 8-chloro-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride?
The IUPAC name of 8-chloro-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride (CID 164623616) is 8-chloro-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride.
What is the SMILES notation for 8-chloro-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride?
The canonical SMILES for 8-chloro-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride is Cl.Nc1c2c(nc3cccc(Cl)c13)CCCC2.
What is the InChIKey of 8-chloro-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride?
The InChIKey is YTBDDSDAOSLSRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN2.ClH/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);1H.
What are the key properties of 8-chloro-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride?
8-chloro-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride has a molecular weight of 269.17 g/mol, XLogP of 3.77, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride is sourced from PubChem (CID 164623616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).