6-methyl-N-[5-[(5-methylpyridine-3-carbonyl)amino]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide

C22H26N4O2 — CID 70498464

About 6-methyl-N-[5-[(5-methylpyridine-3-carbonyl)amino]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide

6-methyl-N-[5-[(5-methylpyridine-3-carbonyl)amino]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide (PubChem CID 70498464) has the molecular formula C22H26N4O2 and a molecular weight of 378.48 g/mol. Its IUPAC name is 6-methyl-N-[5-[(5-methylpyridine-3-carbonyl)amino]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: 6-methyl-N-[5-[(5-methylpyridine-3-carbonyl)amino]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide
• PubChem CID: 70498464
• Molecular Formula: C22H26N4O2
• Molecular Weight: 378.48 g/mol
• Exact Mass: 378.21
• IUPAC Name: 6-methyl-N-[5-[(5-methylpyridine-3-carbonyl)amino]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide
• SMILES: Cc1cncc(C(=O)NC23CCCC(NC(=O)c4cccc(C)n4)(CC2)C3)c1
• InChI: InChI=1S/C22H26N4O2/c1-15-11-17(13-23-12-15)19(27)25-21-7-4-8-22(14-21,10-9-21)26-20(28)18-6-3-5-16(2)24-18/h3,5-6,11-13H,4,7-10,14H2,1-2H3,(H,25,27)(H,26,28)
• InChIKey: PVZNYSSKYOICRD-UHFFFAOYSA-N
• XLogP: 3.10
• TPSA: 83.98 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	378.48
LogP ≤ 5	3.10
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[5-[(5-methylpyridine-3-carbonyl)amino]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide?

The IUPAC name of 6-methyl-N-[5-[(5-methylpyridine-3-carbonyl)amino]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide (CID 70498464) is 6-methyl-N-[5-[(5-methylpyridine-3-carbonyl)amino]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide.

What is the SMILES notation for 6-methyl-N-[5-[(5-methylpyridine-3-carbonyl)amino]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide?

The canonical SMILES for 6-methyl-N-[5-[(5-methylpyridine-3-carbonyl)amino]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide is Cc1cncc(C(=O)NC23CCCC(NC(=O)c4cccc(C)n4)(CC2)C3)c1.

What is the InChIKey of 6-methyl-N-[5-[(5-methylpyridine-3-carbonyl)amino]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide?

The InChIKey is PVZNYSSKYOICRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O2/c1-15-11-17(13-23-12-15)19(27)25-21-7-4-8-22(14-21,10-9-21)26-20(28)18-6-3-5-16(2)24-18/h3,5-6,11-13H,4,7-10,14H2,1-2H3,(H,25,27)(H,26,28).

What are the key properties of 6-methyl-N-[5-[(5-methylpyridine-3-carbonyl)amino]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide?

6-methyl-N-[5-[(5-methylpyridine-3-carbonyl)amino]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide has a molecular weight of 378.48 g/mol, XLogP of 3.10, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 6-methyl-N-[5-[(5-methylpyridine-3-carbonyl)amino]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide is sourced from PubChem (CID 70498464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).