5-methoxy-2-[(1-methylpiperidin-3-yl)methyl]imidazo[1,2-a]pyridine

C15H21N3O — CID 117132250

IUPAC5-methoxy-2-[(1-methylpiperidin-3-yl)methyl]imidazo[1,2-a]pyridine
SMILESCOc1cccc2nc(CC3CCCN(C)C3)cn12
InChIInChI=1S/C15H21N3O/c1-17-8-4-5-12(10-17)9-13-11-18-14(16-13)6-3-7-15(18)19-2/h3,6-7,11-12H,4-5,8-10H2,1-2H3
InChIKeyNVGJUDNAMUZJRV-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.23
Rot. Bonds3

About 5-methoxy-2-[(1-methylpiperidin-3-yl)methyl]imidazo[1,2-a]pyridine

5-methoxy-2-[(1-methylpiperidin-3-yl)methyl]imidazo[1,2-a]pyridine (PubChem CID 117132250) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 5-methoxy-2-[(1-methylpiperidin-3-yl)methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name5-methoxy-2-[(1-methylpiperidin-3-yl)methyl]imidazo[1,2-a]pyridine
PubChem CID117132250
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name5-methoxy-2-[(1-methylpiperidin-3-yl)methyl]imidazo[1,2-a]pyridine
SMILESCOc1cccc2nc(CC3CCCN(C)C3)cn12
InChIInChI=1S/C15H21N3O/c1-17-8-4-5-12(10-17)9-13-11-18-14(16-13)6-3-7-15(18)19-2/h3,6-7,11-12H,4-5,8-10H2,1-2H3
InChIKeyNVGJUDNAMUZJRV-UHFFFAOYSA-N
XLogP2.23
TPSA29.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-[(1-methylpiperidin-3-yl)methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 5-methoxy-2-[(1-methylpiperidin-3-yl)methyl]imidazo[1,2-a]pyridine (CID 117132250) is 5-methoxy-2-[(1-methylpiperidin-3-yl)methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 5-methoxy-2-[(1-methylpiperidin-3-yl)methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 5-methoxy-2-[(1-methylpiperidin-3-yl)methyl]imidazo[1,2-a]pyridine is COc1cccc2nc(CC3CCCN(C)C3)cn12.
What is the InChIKey of 5-methoxy-2-[(1-methylpiperidin-3-yl)methyl]imidazo[1,2-a]pyridine?
The InChIKey is NVGJUDNAMUZJRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-17-8-4-5-12(10-17)9-13-11-18-14(16-13)6-3-7-15(18)19-2/h3,6-7,11-12H,4-5,8-10H2,1-2H3.
What are the key properties of 5-methoxy-2-[(1-methylpiperidin-3-yl)methyl]imidazo[1,2-a]pyridine?
5-methoxy-2-[(1-methylpiperidin-3-yl)methyl]imidazo[1,2-a]pyridine has a molecular weight of 259.35 g/mol, XLogP of 2.23, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-[(1-methylpiperidin-3-yl)methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 117132250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).