3-[7-[2-(dimethylamino)ethoxy]furo[3,2-f]quinolin-1-yl]piperidine-2,6-dione

C20H21N3O4 — CID 149276489

IUPAC3-[7-[2-(dimethylamino)ethoxy]furo[3,2-f]quinolin-1-yl]piperidine-2,6-dione
SMILESCN(C)CCOc1ccc2c(ccc3occ(C4CCC(=O)NC4=O)c32)n1
InChIInChI=1S/C20H21N3O4/c1-23(2)9-10-26-18-8-4-13-15(21-18)5-6-16-19(13)14(11-27-16)12-3-7-17(24)22-20(12)25/h4-6,8,11-12H,3,7,9-10H2,1-2H3,(H,22,24,25)
InChIKeyXSCQJEGZEMFDFC-UHFFFAOYSA-N
MW367.41 g/mol
LogP2.44
Rot. Bonds5

About 3-[7-[2-(dimethylamino)ethoxy]furo[3,2-f]quinolin-1-yl]piperidine-2,6-dione

3-[7-[2-(dimethylamino)ethoxy]furo[3,2-f]quinolin-1-yl]piperidine-2,6-dione (PubChem CID 149276489) has the molecular formula C20H21N3O4 and a molecular weight of 367.41 g/mol. Its IUPAC name is 3-[7-[2-(dimethylamino)ethoxy]furo[3,2-f]quinolin-1-yl]piperidine-2,6-dione.

Molecular Properties

Compound Name3-[7-[2-(dimethylamino)ethoxy]furo[3,2-f]quinolin-1-yl]piperidine-2,6-dione
PubChem CID149276489
Molecular FormulaC20H21N3O4
Molecular Weight367.41 g/mol
Exact Mass367.15
IUPAC Name3-[7-[2-(dimethylamino)ethoxy]furo[3,2-f]quinolin-1-yl]piperidine-2,6-dione
SMILESCN(C)CCOc1ccc2c(ccc3occ(C4CCC(=O)NC4=O)c32)n1
InChIInChI=1S/C20H21N3O4/c1-23(2)9-10-26-18-8-4-13-15(21-18)5-6-16-19(13)14(11-27-16)12-3-7-17(24)22-20(12)25/h4-6,8,11-12H,3,7,9-10H2,1-2H3,(H,22,24,25)
InChIKeyXSCQJEGZEMFDFC-UHFFFAOYSA-N
XLogP2.44
TPSA84.67 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-[7-[2-(dimethylamino)ethoxy]furo[3,2-f]quinolin-1-yl]piperidine-2,6-dione?
The IUPAC name of 3-[7-[2-(dimethylamino)ethoxy]furo[3,2-f]quinolin-1-yl]piperidine-2,6-dione (CID 149276489) is 3-[7-[2-(dimethylamino)ethoxy]furo[3,2-f]quinolin-1-yl]piperidine-2,6-dione.
What is the SMILES notation for 3-[7-[2-(dimethylamino)ethoxy]furo[3,2-f]quinolin-1-yl]piperidine-2,6-dione?
The canonical SMILES for 3-[7-[2-(dimethylamino)ethoxy]furo[3,2-f]quinolin-1-yl]piperidine-2,6-dione is CN(C)CCOc1ccc2c(ccc3occ(C4CCC(=O)NC4=O)c32)n1.
What is the InChIKey of 3-[7-[2-(dimethylamino)ethoxy]furo[3,2-f]quinolin-1-yl]piperidine-2,6-dione?
The InChIKey is XSCQJEGZEMFDFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O4/c1-23(2)9-10-26-18-8-4-13-15(21-18)5-6-16-19(13)14(11-27-16)12-3-7-17(24)22-20(12)25/h4-6,8,11-12H,3,7,9-10H2,1-2H3,(H,22,24,25).
What are the key properties of 3-[7-[2-(dimethylamino)ethoxy]furo[3,2-f]quinolin-1-yl]piperidine-2,6-dione?
3-[7-[2-(dimethylamino)ethoxy]furo[3,2-f]quinolin-1-yl]piperidine-2,6-dione has a molecular weight of 367.41 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[7-[2-(dimethylamino)ethoxy]furo[3,2-f]quinolin-1-yl]piperidine-2,6-dione is sourced from PubChem (CID 149276489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).