5,8-dimethyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine

C18H24N2 — CID 63479127

IUPAC5,8-dimethyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine
SMILESCCCNc1c2c(nc3c(C)ccc(C)c13)CCCC2
InChIInChI=1S/C18H24N2/c1-4-11-19-18-14-7-5-6-8-15(14)20-17-13(3)10-9-12(2)16(17)18/h9-10H,4-8,11H2,1-3H3,(H,19,20)
InChIKeyMJNTZJZBEWAORE-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.55
Rot. Bonds3

About 5,8-dimethyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine

5,8-dimethyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine (PubChem CID 63479127) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 5,8-dimethyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine.

Molecular Properties

Compound Name5,8-dimethyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine
PubChem CID63479127
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name5,8-dimethyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine
SMILESCCCNc1c2c(nc3c(C)ccc(C)c13)CCCC2
InChIInChI=1S/C18H24N2/c1-4-11-19-18-14-7-5-6-8-15(14)20-17-13(3)10-9-12(2)16(17)18/h9-10H,4-8,11H2,1-3H3,(H,19,20)
InChIKeyMJNTZJZBEWAORE-UHFFFAOYSA-N
XLogP4.55
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,8-dimethyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine?
The IUPAC name of 5,8-dimethyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine (CID 63479127) is 5,8-dimethyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine.
What is the SMILES notation for 5,8-dimethyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine?
The canonical SMILES for 5,8-dimethyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine is CCCNc1c2c(nc3c(C)ccc(C)c13)CCCC2.
What is the InChIKey of 5,8-dimethyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine?
The InChIKey is MJNTZJZBEWAORE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-4-11-19-18-14-7-5-6-8-15(14)20-17-13(3)10-9-12(2)16(17)18/h9-10H,4-8,11H2,1-3H3,(H,19,20).
What are the key properties of 5,8-dimethyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine?
5,8-dimethyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine has a molecular weight of 268.40 g/mol, XLogP of 4.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,8-dimethyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine is sourced from PubChem (CID 63479127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).