2-[(1-ethylpiperidin-4-yl)methyl]-6-methoxyimidazo[1,2-a]pyridine

C16H23N3O — CID 117129178

IUPAC2-[(1-ethylpiperidin-4-yl)methyl]-6-methoxyimidazo[1,2-a]pyridine
SMILESCCN1CCC(Cc2cn3cc(OC)ccc3n2)CC1
InChIInChI=1S/C16H23N3O/c1-3-18-8-6-13(7-9-18)10-14-11-19-12-15(20-2)4-5-16(19)17-14/h4-5,11-13H,3,6-10H2,1-2H3
InChIKeyNTTKFHQWZVFACN-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.62
Rot. Bonds4

About 2-[(1-ethylpiperidin-4-yl)methyl]-6-methoxyimidazo[1,2-a]pyridine

2-[(1-ethylpiperidin-4-yl)methyl]-6-methoxyimidazo[1,2-a]pyridine (PubChem CID 117129178) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is 2-[(1-ethylpiperidin-4-yl)methyl]-6-methoxyimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[(1-ethylpiperidin-4-yl)methyl]-6-methoxyimidazo[1,2-a]pyridine
PubChem CID117129178
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC Name2-[(1-ethylpiperidin-4-yl)methyl]-6-methoxyimidazo[1,2-a]pyridine
SMILESCCN1CCC(Cc2cn3cc(OC)ccc3n2)CC1
InChIInChI=1S/C16H23N3O/c1-3-18-8-6-13(7-9-18)10-14-11-19-12-15(20-2)4-5-16(19)17-14/h4-5,11-13H,3,6-10H2,1-2H3
InChIKeyNTTKFHQWZVFACN-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 2-[(1-ethylpiperidin-4-yl)methyl]-6-methoxyimidazo[1,2-a]pyridine?
The IUPAC name of 2-[(1-ethylpiperidin-4-yl)methyl]-6-methoxyimidazo[1,2-a]pyridine (CID 117129178) is 2-[(1-ethylpiperidin-4-yl)methyl]-6-methoxyimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[(1-ethylpiperidin-4-yl)methyl]-6-methoxyimidazo[1,2-a]pyridine?
The canonical SMILES for 2-[(1-ethylpiperidin-4-yl)methyl]-6-methoxyimidazo[1,2-a]pyridine is CCN1CCC(Cc2cn3cc(OC)ccc3n2)CC1.
What is the InChIKey of 2-[(1-ethylpiperidin-4-yl)methyl]-6-methoxyimidazo[1,2-a]pyridine?
The InChIKey is NTTKFHQWZVFACN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O/c1-3-18-8-6-13(7-9-18)10-14-11-19-12-15(20-2)4-5-16(19)17-14/h4-5,11-13H,3,6-10H2,1-2H3.
What are the key properties of 2-[(1-ethylpiperidin-4-yl)methyl]-6-methoxyimidazo[1,2-a]pyridine?
2-[(1-ethylpiperidin-4-yl)methyl]-6-methoxyimidazo[1,2-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 2-[(1-ethylpiperidin-4-yl)methyl]-6-methoxyimidazo[1,2-a]pyridine is sourced from PubChem (CID 117129178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).