1-pyridin-3-yl-1,2,3,4-tetrahydroacridin-9-amine

C18H17N3 — CID 175776950

IUPAC1-pyridin-3-yl-1,2,3,4-tetrahydroacridin-9-amine
SMILESNc1c2c(nc3ccccc13)CCCC2c1cccnc1
InChIInChI=1S/C18H17N3/c19-18-14-6-1-2-8-15(14)21-16-9-3-7-13(17(16)18)12-5-4-10-20-11-12/h1-2,4-6,8,10-11,13H,3,7,9H2,(H2,19,21)
InChIKeyWLXBVPPRIFPJDM-UHFFFAOYSA-N
MW275.36 g/mol
LogP3.68
Rot. Bonds1

About 1-pyridin-3-yl-1,2,3,4-tetrahydroacridin-9-amine

1-pyridin-3-yl-1,2,3,4-tetrahydroacridin-9-amine (PubChem CID 175776950) has the molecular formula C18H17N3 and a molecular weight of 275.36 g/mol. Its IUPAC name is 1-pyridin-3-yl-1,2,3,4-tetrahydroacridin-9-amine.

Molecular Properties

Compound Name1-pyridin-3-yl-1,2,3,4-tetrahydroacridin-9-amine
PubChem CID175776950
Molecular FormulaC18H17N3
Molecular Weight275.36 g/mol
Exact Mass275.14
IUPAC Name1-pyridin-3-yl-1,2,3,4-tetrahydroacridin-9-amine
SMILESNc1c2c(nc3ccccc13)CCCC2c1cccnc1
InChIInChI=1S/C18H17N3/c19-18-14-6-1-2-8-15(14)21-16-9-3-7-13(17(16)18)12-5-4-10-20-11-12/h1-2,4-6,8,10-11,13H,3,7,9H2,(H2,19,21)
InChIKeyWLXBVPPRIFPJDM-UHFFFAOYSA-N
XLogP3.68
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-pyridin-3-yl-1,2,3,4-tetrahydroacridin-9-amine?
The IUPAC name of 1-pyridin-3-yl-1,2,3,4-tetrahydroacridin-9-amine (CID 175776950) is 1-pyridin-3-yl-1,2,3,4-tetrahydroacridin-9-amine.
What is the SMILES notation for 1-pyridin-3-yl-1,2,3,4-tetrahydroacridin-9-amine?
The canonical SMILES for 1-pyridin-3-yl-1,2,3,4-tetrahydroacridin-9-amine is Nc1c2c(nc3ccccc13)CCCC2c1cccnc1.
What is the InChIKey of 1-pyridin-3-yl-1,2,3,4-tetrahydroacridin-9-amine?
The InChIKey is WLXBVPPRIFPJDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3/c19-18-14-6-1-2-8-15(14)21-16-9-3-7-13(17(16)18)12-5-4-10-20-11-12/h1-2,4-6,8,10-11,13H,3,7,9H2,(H2,19,21).
What are the key properties of 1-pyridin-3-yl-1,2,3,4-tetrahydroacridin-9-amine?
1-pyridin-3-yl-1,2,3,4-tetrahydroacridin-9-amine has a molecular weight of 275.36 g/mol, XLogP of 3.68, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-3-yl-1,2,3,4-tetrahydroacridin-9-amine is sourced from PubChem (CID 175776950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).