6-(4-cyanophenoxy)-N-(2-piperidin-1-ylethyl)quinoline-2-carboxamide

C24H24N4O2 — CID 118273686

IUPAC6-(4-cyanophenoxy)-N-(2-piperidin-1-ylethyl)quinoline-2-carboxamide
SMILESN#Cc1ccc(Oc2ccc3nc(C(=O)NCCN4CCCCC4)ccc3c2)cc1
InChIInChI=1S/C24H24N4O2/c25-17-18-4-7-20(8-5-18)30-21-9-11-22-19(16-21)6-10-23(27-22)24(29)26-12-15-28-13-2-1-3-14-28/h4-11,16H,1-3,12-15H2,(H,26,29)
InChIKeyMWZSXMAZYHEUEU-UHFFFAOYSA-N
MW400.48 g/mol
LogP4.11
Rot. Bonds6

About 6-(4-cyanophenoxy)-N-(2-piperidin-1-ylethyl)quinoline-2-carboxamide

6-(4-cyanophenoxy)-N-(2-piperidin-1-ylethyl)quinoline-2-carboxamide (PubChem CID 118273686) has the molecular formula C24H24N4O2 and a molecular weight of 400.48 g/mol. Its IUPAC name is 6-(4-cyanophenoxy)-N-(2-piperidin-1-ylethyl)quinoline-2-carboxamide.

Molecular Properties

Compound Name6-(4-cyanophenoxy)-N-(2-piperidin-1-ylethyl)quinoline-2-carboxamide
PubChem CID118273686
Molecular FormulaC24H24N4O2
Molecular Weight400.48 g/mol
Exact Mass400.19
IUPAC Name6-(4-cyanophenoxy)-N-(2-piperidin-1-ylethyl)quinoline-2-carboxamide
SMILESN#Cc1ccc(Oc2ccc3nc(C(=O)NCCN4CCCCC4)ccc3c2)cc1
InChIInChI=1S/C24H24N4O2/c25-17-18-4-7-20(8-5-18)30-21-9-11-22-19(16-21)6-10-23(27-22)24(29)26-12-15-28-13-2-1-3-14-28/h4-11,16H,1-3,12-15H2,(H,26,29)
InChIKeyMWZSXMAZYHEUEU-UHFFFAOYSA-N
XLogP4.11
TPSA78.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.48
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(4-cyanophenoxy)-N-(2-piperidin-1-ylethyl)quinoline-2-carboxamide 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 6-(4-cyanophenoxy)-N-(2-piperidin-1-ylethyl)quinoline-2-carboxamide?
The IUPAC name of 6-(4-cyanophenoxy)-N-(2-piperidin-1-ylethyl)quinoline-2-carboxamide (CID 118273686) is 6-(4-cyanophenoxy)-N-(2-piperidin-1-ylethyl)quinoline-2-carboxamide.
What is the SMILES notation for 6-(4-cyanophenoxy)-N-(2-piperidin-1-ylethyl)quinoline-2-carboxamide?
The canonical SMILES for 6-(4-cyanophenoxy)-N-(2-piperidin-1-ylethyl)quinoline-2-carboxamide is N#Cc1ccc(Oc2ccc3nc(C(=O)NCCN4CCCCC4)ccc3c2)cc1.
What is the InChIKey of 6-(4-cyanophenoxy)-N-(2-piperidin-1-ylethyl)quinoline-2-carboxamide?
The InChIKey is MWZSXMAZYHEUEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O2/c25-17-18-4-7-20(8-5-18)30-21-9-11-22-19(16-21)6-10-23(27-22)24(29)26-12-15-28-13-2-1-3-14-28/h4-11,16H,1-3,12-15H2,(H,26,29).
What are the key properties of 6-(4-cyanophenoxy)-N-(2-piperidin-1-ylethyl)quinoline-2-carboxamide?
6-(4-cyanophenoxy)-N-(2-piperidin-1-ylethyl)quinoline-2-carboxamide has a molecular weight of 400.48 g/mol, XLogP of 4.11, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-cyanophenoxy)-N-(2-piperidin-1-ylethyl)quinoline-2-carboxamide is sourced from PubChem (CID 118273686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).