3-[(1-ethylpiperidin-3-yl)methyl]-5-methoxyimidazo[1,5-a]pyridine

C16H23N3O — CID 117140525

IUPAC3-[(1-ethylpiperidin-3-yl)methyl]-5-methoxyimidazo[1,5-a]pyridine
SMILESCCN1CCCC(Cc2ncc3cccc(OC)n23)C1
InChIInChI=1S/C16H23N3O/c1-3-18-9-5-6-13(12-18)10-15-17-11-14-7-4-8-16(20-2)19(14)15/h4,7-8,11,13H,3,5-6,9-10,12H2,1-2H3
InChIKeyXUJFSNOSZJLQMS-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.62
Rot. Bonds4

About 3-[(1-ethylpiperidin-3-yl)methyl]-5-methoxyimidazo[1,5-a]pyridine

3-[(1-ethylpiperidin-3-yl)methyl]-5-methoxyimidazo[1,5-a]pyridine (PubChem CID 117140525) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is 3-[(1-ethylpiperidin-3-yl)methyl]-5-methoxyimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name3-[(1-ethylpiperidin-3-yl)methyl]-5-methoxyimidazo[1,5-a]pyridine
PubChem CID117140525
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC Name3-[(1-ethylpiperidin-3-yl)methyl]-5-methoxyimidazo[1,5-a]pyridine
SMILESCCN1CCCC(Cc2ncc3cccc(OC)n23)C1
InChIInChI=1S/C16H23N3O/c1-3-18-9-5-6-13(12-18)10-15-17-11-14-7-4-8-16(20-2)19(14)15/h4,7-8,11,13H,3,5-6,9-10,12H2,1-2H3
InChIKeyXUJFSNOSZJLQMS-UHFFFAOYSA-N
XLogP2.62
TPSA29.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(1-ethylpiperidin-3-yl)methyl]-5-methoxyimidazo[1,5-a]pyridine?
The IUPAC name of 3-[(1-ethylpiperidin-3-yl)methyl]-5-methoxyimidazo[1,5-a]pyridine (CID 117140525) is 3-[(1-ethylpiperidin-3-yl)methyl]-5-methoxyimidazo[1,5-a]pyridine.
What is the SMILES notation for 3-[(1-ethylpiperidin-3-yl)methyl]-5-methoxyimidazo[1,5-a]pyridine?
The canonical SMILES for 3-[(1-ethylpiperidin-3-yl)methyl]-5-methoxyimidazo[1,5-a]pyridine is CCN1CCCC(Cc2ncc3cccc(OC)n23)C1.
What is the InChIKey of 3-[(1-ethylpiperidin-3-yl)methyl]-5-methoxyimidazo[1,5-a]pyridine?
The InChIKey is XUJFSNOSZJLQMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O/c1-3-18-9-5-6-13(12-18)10-15-17-11-14-7-4-8-16(20-2)19(14)15/h4,7-8,11,13H,3,5-6,9-10,12H2,1-2H3.
What are the key properties of 3-[(1-ethylpiperidin-3-yl)methyl]-5-methoxyimidazo[1,5-a]pyridine?
3-[(1-ethylpiperidin-3-yl)methyl]-5-methoxyimidazo[1,5-a]pyridine has a molecular weight of 273.38 g/mol, XLogP of 2.62, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-ethylpiperidin-3-yl)methyl]-5-methoxyimidazo[1,5-a]pyridine is sourced from PubChem (CID 117140525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).