N-[(1R)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-(2-oxo-1-pyridinyl)acetamide

C16H22N2O2 — CID 129377497

About N-[(1R)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-(2-oxo-1-pyridinyl)acetamide

N-[(1R)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-(2-oxo-1-pyridinyl)acetamide (PubChem CID 129377497) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-[(1R)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-(2-oxo-1-pyridinyl)acetamide.

Molecular Properties

• Compound Name: N-[(1R)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-(2-oxo-1-pyridinyl)acetamide
• PubChem CID: 129377497
• Molecular Formula: C16H22N2O2
• Molecular Weight: 274.36 g/mol
• Exact Mass: 274.17
• IUPAC Name: N-[(1R)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-(2-oxo-1-pyridinyl)acetamide
• SMILES: C[C@@H](NC(=O)Cn1ccccc1=O)[C@H]1C[C@H]2CC[C@H]1C2
• InChI: InChI=1S/C16H22N2O2/c1-11(14-9-12-5-6-13(14)8-12)17-15(19)10-18-7-3-2-4-16(18)20/h2-4,7,11-14H,5-6,8-10H2,1H3,(H,17,19)/t11-,12+,13+,14-/m1/s1
• InChIKey: ASSDPISOGGPUPV-ZOBORPQBSA-N
• XLogP: 1.79
• TPSA: 51.10 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 4
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	274.36
LogP ≤ 5	1.79
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-(2-oxo-1-pyridinyl)acetamide?

The IUPAC name of N-[(1R)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-(2-oxo-1-pyridinyl)acetamide (CID 129377497) is N-[(1R)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-(2-oxo-1-pyridinyl)acetamide.

What is the SMILES notation for N-[(1R)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-(2-oxo-1-pyridinyl)acetamide?

The canonical SMILES for N-[(1R)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-(2-oxo-1-pyridinyl)acetamide is C[C@@H](NC(=O)Cn1ccccc1=O)[C@H]1C[C@H]2CC[C@H]1C2.

What is the InChIKey of N-[(1R)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-(2-oxo-1-pyridinyl)acetamide?

The InChIKey is ASSDPISOGGPUPV-ZOBORPQBSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-11(14-9-12-5-6-13(14)8-12)17-15(19)10-18-7-3-2-4-16(18)20/h2-4,7,11-14H,5-6,8-10H2,1H3,(H,17,19)/t11-,12+,13+,14-/m1/s1.

What are the key properties of N-[(1R)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-(2-oxo-1-pyridinyl)acetamide?

N-[(1R)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-(2-oxo-1-pyridinyl)acetamide has a molecular weight of 274.36 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(1R)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-(2-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 129377497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).