9-pyrrolidin-1-yl-1,2,3,4-tetrahydroacridine

C17H20N2 — CID 14615961

IUPAC9-pyrrolidin-1-yl-1,2,3,4-tetrahydroacridine
SMILESc1ccc2c(N3CCCC3)c3c(nc2c1)CCCC3
InChIInChI=1S/C17H20N2/c1-3-9-15-13(7-1)17(19-11-5-6-12-19)14-8-2-4-10-16(14)18-15/h1,3,7,9H,2,4-6,8,10-12H2
InChIKeyMPPAGJFGXFSONE-UHFFFAOYSA-N
MW252.36 g/mol
LogP3.71
Rot. Bonds1

About 9-pyrrolidin-1-yl-1,2,3,4-tetrahydroacridine

9-pyrrolidin-1-yl-1,2,3,4-tetrahydroacridine (PubChem CID 14615961) has the molecular formula C17H20N2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 9-pyrrolidin-1-yl-1,2,3,4-tetrahydroacridine.

Molecular Properties

Compound Name9-pyrrolidin-1-yl-1,2,3,4-tetrahydroacridine
PubChem CID14615961
Molecular FormulaC17H20N2
Molecular Weight252.36 g/mol
Exact Mass252.16
IUPAC Name9-pyrrolidin-1-yl-1,2,3,4-tetrahydroacridine
SMILESc1ccc2c(N3CCCC3)c3c(nc2c1)CCCC3
InChIInChI=1S/C17H20N2/c1-3-9-15-13(7-1)17(19-11-5-6-12-19)14-8-2-4-10-16(14)18-15/h1,3,7,9H,2,4-6,8,10-12H2
InChIKeyMPPAGJFGXFSONE-UHFFFAOYSA-N
XLogP3.71
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-pyrrolidin-1-yl-1,2,3,4-tetrahydroacridine?
The IUPAC name of 9-pyrrolidin-1-yl-1,2,3,4-tetrahydroacridine (CID 14615961) is 9-pyrrolidin-1-yl-1,2,3,4-tetrahydroacridine.
What is the SMILES notation for 9-pyrrolidin-1-yl-1,2,3,4-tetrahydroacridine?
The canonical SMILES for 9-pyrrolidin-1-yl-1,2,3,4-tetrahydroacridine is c1ccc2c(N3CCCC3)c3c(nc2c1)CCCC3.
What is the InChIKey of 9-pyrrolidin-1-yl-1,2,3,4-tetrahydroacridine?
The InChIKey is MPPAGJFGXFSONE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2/c1-3-9-15-13(7-1)17(19-11-5-6-12-19)14-8-2-4-10-16(14)18-15/h1,3,7,9H,2,4-6,8,10-12H2.
What are the key properties of 9-pyrrolidin-1-yl-1,2,3,4-tetrahydroacridine?
9-pyrrolidin-1-yl-1,2,3,4-tetrahydroacridine has a molecular weight of 252.36 g/mol, XLogP of 3.71, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-pyrrolidin-1-yl-1,2,3,4-tetrahydroacridine is sourced from PubChem (CID 14615961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).