N-[2-[1-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]pyridine-3-carboxamide

C21H23N7OS — CID 42593765

About N-[2-[1-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]pyridine-3-carboxamide

N-[2-[1-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]pyridine-3-carboxamide (PubChem CID 42593765) has the molecular formula C21H23N7OS and a molecular weight of 421.53 g/mol. Its IUPAC name is N-[2-[1-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[2-[1-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]pyridine-3-carboxamide
• PubChem CID: 42593765
• Molecular Formula: C21H23N7OS
• Molecular Weight: 421.53 g/mol
• Exact Mass: 421.17
• IUPAC Name: N-[2-[1-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]pyridine-3-carboxamide
• SMILES: Cc1nc2sccn2c1CN1CCC(n2nccc2NC(=O)c2cccnc2)CC1
• InChI: InChI=1S/C21H23N7OS/c1-15-18(27-11-12-30-21(27)24-15)14-26-9-5-17(6-10-26)28-19(4-8-23-28)25-20(29)16-3-2-7-22-13-16/h2-4,7-8,11-13,17H,5-6,9-10,14H2,1H3,(H,25,29)
• InChIKey: QUPSNYWEKKJSOB-UHFFFAOYSA-N
• XLogP: 3.39
• TPSA: 80.35 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 5
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	421.53
LogP ≤ 5	3.39
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of N-[2-[1-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]pyridine-3-carboxamide?

The IUPAC name of N-[2-[1-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]pyridine-3-carboxamide (CID 42593765) is N-[2-[1-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]pyridine-3-carboxamide.

What is the SMILES notation for N-[2-[1-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]pyridine-3-carboxamide?

The canonical SMILES for N-[2-[1-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]pyridine-3-carboxamide is Cc1nc2sccn2c1CN1CCC(n2nccc2NC(=O)c2cccnc2)CC1.

What is the InChIKey of N-[2-[1-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]pyridine-3-carboxamide?

The InChIKey is QUPSNYWEKKJSOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N7OS/c1-15-18(27-11-12-30-21(27)24-15)14-26-9-5-17(6-10-26)28-19(4-8-23-28)25-20(29)16-3-2-7-22-13-16/h2-4,7-8,11-13,17H,5-6,9-10,14H2,1H3,(H,25,29).

What are the key properties of N-[2-[1-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]pyridine-3-carboxamide?

N-[2-[1-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]pyridine-3-carboxamide has a molecular weight of 421.53 g/mol, XLogP of 3.39, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[1-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]piperidin-4-yl]pyrazol-3-yl]pyridine-3-carboxamide is sourced from PubChem (CID 42593765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).