2-acetyl-N-(2-azabicyclo[2.2.1]heptan-6-yl)furo[3,2-c]pyridine-6-carboxamide

C16H17N3O3 — CID 22389462

IUPAC2-acetyl-N-(2-azabicyclo[2.2.1]heptan-6-yl)furo[3,2-c]pyridine-6-carboxamide
SMILESCC(=O)c1cc2cnc(C(=O)NC3CC4CNC3C4)cc2o1
InChIInChI=1S/C16H17N3O3/c1-8(20)14-4-10-7-18-13(5-15(10)22-14)16(21)19-12-3-9-2-11(12)17-6-9/h4-5,7,9,11-12,17H,2-3,6H2,1H3,(H,19,21)
InChIKeyLZGAVLCYSDXAHK-UHFFFAOYSA-N
MW299.33 g/mol
LogP1.51
Rot. Bonds3

About 2-acetyl-N-(2-azabicyclo[2.2.1]heptan-6-yl)furo[3,2-c]pyridine-6-carboxamide

2-acetyl-N-(2-azabicyclo[2.2.1]heptan-6-yl)furo[3,2-c]pyridine-6-carboxamide (PubChem CID 22389462) has the molecular formula C16H17N3O3 and a molecular weight of 299.33 g/mol. Its IUPAC name is 2-acetyl-N-(2-azabicyclo[2.2.1]heptan-6-yl)furo[3,2-c]pyridine-6-carboxamide.

Molecular Properties

Compound Name2-acetyl-N-(2-azabicyclo[2.2.1]heptan-6-yl)furo[3,2-c]pyridine-6-carboxamide
PubChem CID22389462
Molecular FormulaC16H17N3O3
Molecular Weight299.33 g/mol
Exact Mass299.13
IUPAC Name2-acetyl-N-(2-azabicyclo[2.2.1]heptan-6-yl)furo[3,2-c]pyridine-6-carboxamide
SMILESCC(=O)c1cc2cnc(C(=O)NC3CC4CNC3C4)cc2o1
InChIInChI=1S/C16H17N3O3/c1-8(20)14-4-10-7-18-13(5-15(10)22-14)16(21)19-12-3-9-2-11(12)17-6-9/h4-5,7,9,11-12,17H,2-3,6H2,1H3,(H,19,21)
InChIKeyLZGAVLCYSDXAHK-UHFFFAOYSA-N
XLogP1.51
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-acetyl-N-(2-azabicyclo[2.2.1]heptan-6-yl)furo[3,2-c]pyridine-6-carboxamide?
The IUPAC name of 2-acetyl-N-(2-azabicyclo[2.2.1]heptan-6-yl)furo[3,2-c]pyridine-6-carboxamide (CID 22389462) is 2-acetyl-N-(2-azabicyclo[2.2.1]heptan-6-yl)furo[3,2-c]pyridine-6-carboxamide.
What is the SMILES notation for 2-acetyl-N-(2-azabicyclo[2.2.1]heptan-6-yl)furo[3,2-c]pyridine-6-carboxamide?
The canonical SMILES for 2-acetyl-N-(2-azabicyclo[2.2.1]heptan-6-yl)furo[3,2-c]pyridine-6-carboxamide is CC(=O)c1cc2cnc(C(=O)NC3CC4CNC3C4)cc2o1.
What is the InChIKey of 2-acetyl-N-(2-azabicyclo[2.2.1]heptan-6-yl)furo[3,2-c]pyridine-6-carboxamide?
The InChIKey is LZGAVLCYSDXAHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3/c1-8(20)14-4-10-7-18-13(5-15(10)22-14)16(21)19-12-3-9-2-11(12)17-6-9/h4-5,7,9,11-12,17H,2-3,6H2,1H3,(H,19,21).
What are the key properties of 2-acetyl-N-(2-azabicyclo[2.2.1]heptan-6-yl)furo[3,2-c]pyridine-6-carboxamide?
2-acetyl-N-(2-azabicyclo[2.2.1]heptan-6-yl)furo[3,2-c]pyridine-6-carboxamide has a molecular weight of 299.33 g/mol, XLogP of 1.51, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetyl-N-(2-azabicyclo[2.2.1]heptan-6-yl)furo[3,2-c]pyridine-6-carboxamide is sourced from PubChem (CID 22389462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).