2,8-dimethyl-1-(1-methylpiperidin-3-yl)imidazo[4,5-c]quinoline

C18H22N4 — CID 123526560

IUPAC2,8-dimethyl-1-(1-methylpiperidin-3-yl)imidazo[4,5-c]quinoline
SMILESCc1ccc2ncc3nc(C)n(C4CCCN(C)C4)c3c2c1
InChIInChI=1S/C18H22N4/c1-12-6-7-16-15(9-12)18-17(10-19-16)20-13(2)22(18)14-5-4-8-21(3)11-14/h6-7,9-10,14H,4-5,8,11H2,1-3H3
InChIKeyKWGZHFOENORECO-UHFFFAOYSA-N
MW294.40 g/mol
LogP3.47
Rot. Bonds1

About 2,8-dimethyl-1-(1-methylpiperidin-3-yl)imidazo[4,5-c]quinoline

2,8-dimethyl-1-(1-methylpiperidin-3-yl)imidazo[4,5-c]quinoline (PubChem CID 123526560) has the molecular formula C18H22N4 and a molecular weight of 294.40 g/mol. Its IUPAC name is 2,8-dimethyl-1-(1-methylpiperidin-3-yl)imidazo[4,5-c]quinoline.

Molecular Properties

Compound Name2,8-dimethyl-1-(1-methylpiperidin-3-yl)imidazo[4,5-c]quinoline
PubChem CID123526560
Molecular FormulaC18H22N4
Molecular Weight294.40 g/mol
Exact Mass294.18
IUPAC Name2,8-dimethyl-1-(1-methylpiperidin-3-yl)imidazo[4,5-c]quinoline
SMILESCc1ccc2ncc3nc(C)n(C4CCCN(C)C4)c3c2c1
InChIInChI=1S/C18H22N4/c1-12-6-7-16-15(9-12)18-17(10-19-16)20-13(2)22(18)14-5-4-8-21(3)11-14/h6-7,9-10,14H,4-5,8,11H2,1-3H3
InChIKeyKWGZHFOENORECO-UHFFFAOYSA-N
XLogP3.47
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,8-dimethyl-1-(1-methylpiperidin-3-yl)imidazo[4,5-c]quinoline?
The IUPAC name of 2,8-dimethyl-1-(1-methylpiperidin-3-yl)imidazo[4,5-c]quinoline (CID 123526560) is 2,8-dimethyl-1-(1-methylpiperidin-3-yl)imidazo[4,5-c]quinoline.
What is the SMILES notation for 2,8-dimethyl-1-(1-methylpiperidin-3-yl)imidazo[4,5-c]quinoline?
The canonical SMILES for 2,8-dimethyl-1-(1-methylpiperidin-3-yl)imidazo[4,5-c]quinoline is Cc1ccc2ncc3nc(C)n(C4CCCN(C)C4)c3c2c1.
What is the InChIKey of 2,8-dimethyl-1-(1-methylpiperidin-3-yl)imidazo[4,5-c]quinoline?
The InChIKey is KWGZHFOENORECO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4/c1-12-6-7-16-15(9-12)18-17(10-19-16)20-13(2)22(18)14-5-4-8-21(3)11-14/h6-7,9-10,14H,4-5,8,11H2,1-3H3.
What are the key properties of 2,8-dimethyl-1-(1-methylpiperidin-3-yl)imidazo[4,5-c]quinoline?
2,8-dimethyl-1-(1-methylpiperidin-3-yl)imidazo[4,5-c]quinoline has a molecular weight of 294.40 g/mol, XLogP of 3.47, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,8-dimethyl-1-(1-methylpiperidin-3-yl)imidazo[4,5-c]quinoline is sourced from PubChem (CID 123526560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).