10-[3-(dimethylamino)propyl]-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione

C18H26N2O2 — CID 171053503

IUPAC10-[3-(dimethylamino)propyl]-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione
SMILESCN(C)CCCN1C2=C(CC3=C1CCCC3=O)C(=O)CCC2
InChIInChI=1S/C18H26N2O2/c1-19(2)10-5-11-20-15-6-3-8-17(21)13(15)12-14-16(20)7-4-9-18(14)22/h3-12H2,1-2H3
InChIKeySNRJBXQGNIDWRB-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.66
Rot. Bonds4

About 10-[3-(dimethylamino)propyl]-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione

10-[3-(dimethylamino)propyl]-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione (PubChem CID 171053503) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is 10-[3-(dimethylamino)propyl]-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione.

Molecular Properties

Compound Name10-[3-(dimethylamino)propyl]-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione
PubChem CID171053503
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC Name10-[3-(dimethylamino)propyl]-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione
SMILESCN(C)CCCN1C2=C(CC3=C1CCCC3=O)C(=O)CCC2
InChIInChI=1S/C18H26N2O2/c1-19(2)10-5-11-20-15-6-3-8-17(21)13(15)12-14-16(20)7-4-9-18(14)22/h3-12H2,1-2H3
InChIKeySNRJBXQGNIDWRB-UHFFFAOYSA-N
XLogP2.66
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 10-[3-(dimethylamino)propyl]-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione 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 10-[3-(dimethylamino)propyl]-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione?
The IUPAC name of 10-[3-(dimethylamino)propyl]-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione (CID 171053503) is 10-[3-(dimethylamino)propyl]-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione.
What is the SMILES notation for 10-[3-(dimethylamino)propyl]-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione?
The canonical SMILES for 10-[3-(dimethylamino)propyl]-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione is CN(C)CCCN1C2=C(CC3=C1CCCC3=O)C(=O)CCC2.
What is the InChIKey of 10-[3-(dimethylamino)propyl]-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione?
The InChIKey is SNRJBXQGNIDWRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-19(2)10-5-11-20-15-6-3-8-17(21)13(15)12-14-16(20)7-4-9-18(14)22/h3-12H2,1-2H3.
What are the key properties of 10-[3-(dimethylamino)propyl]-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione?
10-[3-(dimethylamino)propyl]-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione has a molecular weight of 302.42 g/mol, XLogP of 2.66, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[3-(dimethylamino)propyl]-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione is sourced from PubChem (CID 171053503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).