4-(2-ethylpiperidin-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide

C22H24N4O — CID 109218076

IUPAC4-(2-ethylpiperidin-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide
SMILESCCC1CCCCN1c1ccnc(C(=O)Nc2cccc3cccnc23)c1
InChIInChI=1S/C22H24N4O/c1-2-17-9-3-4-14-26(17)18-11-13-23-20(15-18)22(27)25-19-10-5-7-16-8-6-12-24-21(16)19/h5-8,10-13,15,17H,2-4,9,14H2,1H3,(H,25,27)
InChIKeyOZCPUUZBLIOYDD-UHFFFAOYSA-N
MW360.46 g/mol
LogP4.65
Rot. Bonds4

About 4-(2-ethylpiperidin-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide

4-(2-ethylpiperidin-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide (PubChem CID 109218076) has the molecular formula C22H24N4O and a molecular weight of 360.46 g/mol. Its IUPAC name is 4-(2-ethylpiperidin-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(2-ethylpiperidin-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide
PubChem CID109218076
Molecular FormulaC22H24N4O
Molecular Weight360.46 g/mol
Exact Mass360.20
IUPAC Name4-(2-ethylpiperidin-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide
SMILESCCC1CCCCN1c1ccnc(C(=O)Nc2cccc3cccnc23)c1
InChIInChI=1S/C22H24N4O/c1-2-17-9-3-4-14-26(17)18-11-13-23-20(15-18)22(27)25-19-10-5-7-16-8-6-12-24-21(16)19/h5-8,10-13,15,17H,2-4,9,14H2,1H3,(H,25,27)
InChIKeyOZCPUUZBLIOYDD-UHFFFAOYSA-N
XLogP4.65
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-ethylpiperidin-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide?
The IUPAC name of 4-(2-ethylpiperidin-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide (CID 109218076) is 4-(2-ethylpiperidin-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide.
What is the SMILES notation for 4-(2-ethylpiperidin-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide?
The canonical SMILES for 4-(2-ethylpiperidin-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide is CCC1CCCCN1c1ccnc(C(=O)Nc2cccc3cccnc23)c1.
What is the InChIKey of 4-(2-ethylpiperidin-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide?
The InChIKey is OZCPUUZBLIOYDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O/c1-2-17-9-3-4-14-26(17)18-11-13-23-20(15-18)22(27)25-19-10-5-7-16-8-6-12-24-21(16)19/h5-8,10-13,15,17H,2-4,9,14H2,1H3,(H,25,27).
What are the key properties of 4-(2-ethylpiperidin-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide?
4-(2-ethylpiperidin-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide has a molecular weight of 360.46 g/mol, XLogP of 4.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethylpiperidin-1-yl)-N-quinolin-8-ylpyridine-2-carboxamide is sourced from PubChem (CID 109218076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).