N-[(5R)-5-[(6-methyl-2-pyridinyl)carbamoyl]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide

C21H24N4O2 — CID 130286496

About N-[(5R)-5-[(6-methyl-2-pyridinyl)carbamoyl]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide

N-[(5R)-5-[(6-methyl-2-pyridinyl)carbamoyl]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide (PubChem CID 130286496) has the molecular formula C21H24N4O2 and a molecular weight of 364.45 g/mol. Its IUPAC name is N-[(5R)-5-[(6-methyl-2-pyridinyl)carbamoyl]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: N-[(5R)-5-[(6-methyl-2-pyridinyl)carbamoyl]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide
• PubChem CID: 130286496
• Molecular Formula: C21H24N4O2
• Molecular Weight: 364.45 g/mol
• Exact Mass: 364.19
• IUPAC Name: N-[(5R)-5-[(6-methyl-2-pyridinyl)carbamoyl]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide
• SMILES: Cc1cccc(NC(=O)[C@]23CCCC(NC(=O)c4ccccn4)(CC2)C3)n1
• InChI: InChI=1S/C21H24N4O2/c1-15-6-4-8-17(23-15)24-19(27)20-9-5-10-21(14-20,12-11-20)25-18(26)16-7-2-3-13-22-16/h2-4,6-8,13H,5,9-12,14H2,1H3,(H,25,26)(H,23,24,27)/t20-,21?/m1/s1
• InChIKey: RIEHSFZHPBDKTM-VQCQRNETSA-N
• XLogP: 3.25
• TPSA: 83.98 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	364.45
LogP ≤ 5	3.25
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-[(5R)-5-[(6-methyl-2-pyridinyl)carbamoyl]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide?

The IUPAC name of N-[(5R)-5-[(6-methyl-2-pyridinyl)carbamoyl]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide (CID 130286496) is N-[(5R)-5-[(6-methyl-2-pyridinyl)carbamoyl]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide.

What is the SMILES notation for N-[(5R)-5-[(6-methyl-2-pyridinyl)carbamoyl]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide?

The canonical SMILES for N-[(5R)-5-[(6-methyl-2-pyridinyl)carbamoyl]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide is Cc1cccc(NC(=O)[C@]23CCCC(NC(=O)c4ccccn4)(CC2)C3)n1.

What is the InChIKey of N-[(5R)-5-[(6-methyl-2-pyridinyl)carbamoyl]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide?

The InChIKey is RIEHSFZHPBDKTM-VQCQRNETSA-N. The full InChI is InChI=1S/C21H24N4O2/c1-15-6-4-8-17(23-15)24-19(27)20-9-5-10-21(14-20,12-11-20)25-18(26)16-7-2-3-13-22-16/h2-4,6-8,13H,5,9-12,14H2,1H3,(H,25,26)(H,23,24,27)/t20-,21?/m1/s1.

What are the key properties of N-[(5R)-5-[(6-methyl-2-pyridinyl)carbamoyl]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide?

N-[(5R)-5-[(6-methyl-2-pyridinyl)carbamoyl]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide has a molecular weight of 364.45 g/mol, XLogP of 3.25, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(5R)-5-[(6-methyl-2-pyridinyl)carbamoyl]-1-bicyclo[3.2.1]octanyl]pyridine-2-carboxamide is sourced from PubChem (CID 130286496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).