2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)acetamide;hydrochloride

C18H24ClFN2O — CID 119745340

About 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)acetamide;hydrochloride

2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)acetamide;hydrochloride (PubChem CID 119745340) has the molecular formula C18H24ClFN2O and a molecular weight of 338.85 g/mol. Its IUPAC name is 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)acetamide;hydrochloride.

Molecular Properties

• Compound Name: 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)acetamide;hydrochloride
• PubChem CID: 119745340
• Molecular Formula: C18H24ClFN2O
• Molecular Weight: 338.85 g/mol
• Exact Mass: 338.16
• IUPAC Name: 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)acetamide;hydrochloride
• SMILES: Cl.O=C(CC1CC2CCC(C1)N2)NC1CCc2cc(F)ccc21
• InChI: InChI=1S/C18H23FN2O.ClH/c19-13-2-5-16-12(10-13)1-6-17(16)21-18(22)9-11-7-14-3-4-15(8-11)20-14;/h2,5,10-11,14-15,17,20H,1,3-4,6-9H2,(H,21,22);1H
• InChIKey: QOPHMBSHECWPOV-UHFFFAOYSA-N
• XLogP: 3.27
• TPSA: 41.13 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 2
• Rotatable Bonds: 3
• Heavy Atoms: 23
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	338.85
LogP ≤ 5	3.27
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)acetamide;hydrochloride?

The IUPAC name of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)acetamide;hydrochloride (CID 119745340) is 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)acetamide;hydrochloride.

What is the SMILES notation for 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)acetamide;hydrochloride?

The canonical SMILES for 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)acetamide;hydrochloride is Cl.O=C(CC1CC2CCC(C1)N2)NC1CCc2cc(F)ccc21.

What is the InChIKey of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)acetamide;hydrochloride?

The InChIKey is QOPHMBSHECWPOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23FN2O.ClH/c19-13-2-5-16-12(10-13)1-6-17(16)21-18(22)9-11-7-14-3-4-15(8-11)20-14;/h2,5,10-11,14-15,17,20H,1,3-4,6-9H2,(H,21,22);1H.

What are the key properties of 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)acetamide;hydrochloride?

2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)acetamide;hydrochloride has a molecular weight of 338.85 g/mol, XLogP of 3.27, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)acetamide;hydrochloride is sourced from PubChem (CID 119745340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).