5-(2,6-dimethylpiperidin-4-yl)-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)cinnoline-8-carboxamide

C24H25FN6O — CID 167500800

IUPAC5-(2,6-dimethylpiperidin-4-yl)-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)cinnoline-8-carboxamide
SMILESCc1cn2cc(NC(=O)c3ccc(C4CC(C)NC(C)C4)c4ccnnc34)cc(F)c2n1
InChIInChI=1S/C24H25FN6O/c1-13-8-16(9-14(2)27-13)18-4-5-20(22-19(18)6-7-26-30-22)24(32)29-17-10-21(25)23-28-15(3)11-31(23)12-17/h4-7,10-14,16,27H,8-9H2,1-3H3,(H,29,32)
InChIKeyJZTKUFXZKATNDO-UHFFFAOYSA-N
MW432.50 g/mol
LogP4.22
Rot. Bonds3

About 5-(2,6-dimethylpiperidin-4-yl)-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)cinnoline-8-carboxamide

5-(2,6-dimethylpiperidin-4-yl)-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)cinnoline-8-carboxamide (PubChem CID 167500800) has the molecular formula C24H25FN6O and a molecular weight of 432.50 g/mol. Its IUPAC name is 5-(2,6-dimethylpiperidin-4-yl)-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)cinnoline-8-carboxamide.

Molecular Properties

Compound Name5-(2,6-dimethylpiperidin-4-yl)-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)cinnoline-8-carboxamide
PubChem CID167500800
Molecular FormulaC24H25FN6O
Molecular Weight432.50 g/mol
Exact Mass432.21
IUPAC Name5-(2,6-dimethylpiperidin-4-yl)-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)cinnoline-8-carboxamide
SMILESCc1cn2cc(NC(=O)c3ccc(C4CC(C)NC(C)C4)c4ccnnc34)cc(F)c2n1
InChIInChI=1S/C24H25FN6O/c1-13-8-16(9-14(2)27-13)18-4-5-20(22-19(18)6-7-26-30-22)24(32)29-17-10-21(25)23-28-15(3)11-31(23)12-17/h4-7,10-14,16,27H,8-9H2,1-3H3,(H,29,32)
InChIKeyJZTKUFXZKATNDO-UHFFFAOYSA-N
XLogP4.22
TPSA84.21 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.50
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(2,6-dimethylpiperidin-4-yl)-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)cinnoline-8-carboxamide?
The IUPAC name of 5-(2,6-dimethylpiperidin-4-yl)-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)cinnoline-8-carboxamide (CID 167500800) is 5-(2,6-dimethylpiperidin-4-yl)-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)cinnoline-8-carboxamide.
What is the SMILES notation for 5-(2,6-dimethylpiperidin-4-yl)-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)cinnoline-8-carboxamide?
The canonical SMILES for 5-(2,6-dimethylpiperidin-4-yl)-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)cinnoline-8-carboxamide is Cc1cn2cc(NC(=O)c3ccc(C4CC(C)NC(C)C4)c4ccnnc34)cc(F)c2n1.
What is the InChIKey of 5-(2,6-dimethylpiperidin-4-yl)-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)cinnoline-8-carboxamide?
The InChIKey is JZTKUFXZKATNDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25FN6O/c1-13-8-16(9-14(2)27-13)18-4-5-20(22-19(18)6-7-26-30-22)24(32)29-17-10-21(25)23-28-15(3)11-31(23)12-17/h4-7,10-14,16,27H,8-9H2,1-3H3,(H,29,32).
What are the key properties of 5-(2,6-dimethylpiperidin-4-yl)-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)cinnoline-8-carboxamide?
5-(2,6-dimethylpiperidin-4-yl)-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)cinnoline-8-carboxamide has a molecular weight of 432.50 g/mol, XLogP of 4.22, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,6-dimethylpiperidin-4-yl)-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)cinnoline-8-carboxamide is sourced from PubChem (CID 167500800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).