2-(3-azabicyclo[3.2.1]octan-8-yl)-N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide

C20H28N4O — CID 166856727

IUPAC2-(3-azabicyclo[3.2.1]octan-8-yl)-N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide
SMILESCc1cccn2c(C(C)(C)NC(=O)CC3C4CCC3CNC4)ncc12
InChIInChI=1S/C20H28N4O/c1-13-5-4-8-24-17(13)12-22-19(24)20(2,3)23-18(25)9-16-14-6-7-15(16)11-21-10-14/h4-5,8,12,14-16,21H,6-7,9-11H2,1-3H3,(H,23,25)
InChIKeyUZXVHYQGWRCFRD-UHFFFAOYSA-N
MW340.47 g/mol
LogP2.63
Rot. Bonds4

About 2-(3-azabicyclo[3.2.1]octan-8-yl)-N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide

2-(3-azabicyclo[3.2.1]octan-8-yl)-N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide (PubChem CID 166856727) has the molecular formula C20H28N4O and a molecular weight of 340.47 g/mol. Its IUPAC name is 2-(3-azabicyclo[3.2.1]octan-8-yl)-N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide.

Molecular Properties

Compound Name2-(3-azabicyclo[3.2.1]octan-8-yl)-N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide
PubChem CID166856727
Molecular FormulaC20H28N4O
Molecular Weight340.47 g/mol
Exact Mass340.23
IUPAC Name2-(3-azabicyclo[3.2.1]octan-8-yl)-N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide
SMILESCc1cccn2c(C(C)(C)NC(=O)CC3C4CCC3CNC4)ncc12
InChIInChI=1S/C20H28N4O/c1-13-5-4-8-24-17(13)12-22-19(24)20(2,3)23-18(25)9-16-14-6-7-15(16)11-21-10-14/h4-5,8,12,14-16,21H,6-7,9-11H2,1-3H3,(H,23,25)
InChIKeyUZXVHYQGWRCFRD-UHFFFAOYSA-N
XLogP2.63
TPSA58.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-azabicyclo[3.2.1]octan-8-yl)-N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide?
The IUPAC name of 2-(3-azabicyclo[3.2.1]octan-8-yl)-N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide (CID 166856727) is 2-(3-azabicyclo[3.2.1]octan-8-yl)-N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide.
What is the SMILES notation for 2-(3-azabicyclo[3.2.1]octan-8-yl)-N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide?
The canonical SMILES for 2-(3-azabicyclo[3.2.1]octan-8-yl)-N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide is Cc1cccn2c(C(C)(C)NC(=O)CC3C4CCC3CNC4)ncc12.
What is the InChIKey of 2-(3-azabicyclo[3.2.1]octan-8-yl)-N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide?
The InChIKey is UZXVHYQGWRCFRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O/c1-13-5-4-8-24-17(13)12-22-19(24)20(2,3)23-18(25)9-16-14-6-7-15(16)11-21-10-14/h4-5,8,12,14-16,21H,6-7,9-11H2,1-3H3,(H,23,25).
What are the key properties of 2-(3-azabicyclo[3.2.1]octan-8-yl)-N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide?
2-(3-azabicyclo[3.2.1]octan-8-yl)-N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide has a molecular weight of 340.47 g/mol, XLogP of 2.63, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-azabicyclo[3.2.1]octan-8-yl)-N-[2-(8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]acetamide is sourced from PubChem (CID 166856727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).