3-ethyl-8-(1-ethylpiperidin-3-yl)-7,8-dimethyl-2H-quinoline

C20H30N2 — CID 22482425

IUPAC3-ethyl-8-(1-ethylpiperidin-3-yl)-7,8-dimethyl-2H-quinoline
SMILESCCC1=CC2=CC=C(C)C(C)(C3CCCN(CC)C3)C2=NC1
InChIInChI=1S/C20H30N2/c1-5-16-12-17-10-9-15(3)20(4,19(17)21-13-16)18-8-7-11-22(6-2)14-18/h9-10,12,18H,5-8,11,13-14H2,1-4H3
InChIKeyYSNGZCRKUHMGTI-UHFFFAOYSA-N
MW298.47 g/mol
LogP4.40
Rot. Bonds3

About 3-ethyl-8-(1-ethylpiperidin-3-yl)-7,8-dimethyl-2H-quinoline

3-ethyl-8-(1-ethylpiperidin-3-yl)-7,8-dimethyl-2H-quinoline (PubChem CID 22482425) has the molecular formula C20H30N2 and a molecular weight of 298.47 g/mol. Its IUPAC name is 3-ethyl-8-(1-ethylpiperidin-3-yl)-7,8-dimethyl-2H-quinoline.

Molecular Properties

Compound Name3-ethyl-8-(1-ethylpiperidin-3-yl)-7,8-dimethyl-2H-quinoline
PubChem CID22482425
Molecular FormulaC20H30N2
Molecular Weight298.47 g/mol
Exact Mass298.24
IUPAC Name3-ethyl-8-(1-ethylpiperidin-3-yl)-7,8-dimethyl-2H-quinoline
SMILESCCC1=CC2=CC=C(C)C(C)(C3CCCN(CC)C3)C2=NC1
InChIInChI=1S/C20H30N2/c1-5-16-12-17-10-9-15(3)20(4,19(17)21-13-16)18-8-7-11-22(6-2)14-18/h9-10,12,18H,5-8,11,13-14H2,1-4H3
InChIKeyYSNGZCRKUHMGTI-UHFFFAOYSA-N
XLogP4.40
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-ethyl-8-(1-ethylpiperidin-3-yl)-7,8-dimethyl-2H-quinoline 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 3-ethyl-8-(1-ethylpiperidin-3-yl)-7,8-dimethyl-2H-quinoline?
The IUPAC name of 3-ethyl-8-(1-ethylpiperidin-3-yl)-7,8-dimethyl-2H-quinoline (CID 22482425) is 3-ethyl-8-(1-ethylpiperidin-3-yl)-7,8-dimethyl-2H-quinoline.
What is the SMILES notation for 3-ethyl-8-(1-ethylpiperidin-3-yl)-7,8-dimethyl-2H-quinoline?
The canonical SMILES for 3-ethyl-8-(1-ethylpiperidin-3-yl)-7,8-dimethyl-2H-quinoline is CCC1=CC2=CC=C(C)C(C)(C3CCCN(CC)C3)C2=NC1.
What is the InChIKey of 3-ethyl-8-(1-ethylpiperidin-3-yl)-7,8-dimethyl-2H-quinoline?
The InChIKey is YSNGZCRKUHMGTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2/c1-5-16-12-17-10-9-15(3)20(4,19(17)21-13-16)18-8-7-11-22(6-2)14-18/h9-10,12,18H,5-8,11,13-14H2,1-4H3.
What are the key properties of 3-ethyl-8-(1-ethylpiperidin-3-yl)-7,8-dimethyl-2H-quinoline?
3-ethyl-8-(1-ethylpiperidin-3-yl)-7,8-dimethyl-2H-quinoline has a molecular weight of 298.47 g/mol, XLogP of 4.40, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-8-(1-ethylpiperidin-3-yl)-7,8-dimethyl-2H-quinoline is sourced from PubChem (CID 22482425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).