6-methoxy-3-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine

C14H19N3O — CID 117137929

IUPAC6-methoxy-3-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine
SMILESCOc1ccc2cnc(CC3CCN(C)C3)n2c1
InChIInChI=1S/C14H19N3O/c1-16-6-5-11(9-16)7-14-15-8-12-3-4-13(18-2)10-17(12)14/h3-4,8,10-11H,5-7,9H2,1-2H3
InChIKeyGRUMDOCVSZEEKA-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.84
Rot. Bonds3

About 6-methoxy-3-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine

6-methoxy-3-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine (PubChem CID 117137929) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 6-methoxy-3-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name6-methoxy-3-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine
PubChem CID117137929
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name6-methoxy-3-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine
SMILESCOc1ccc2cnc(CC3CCN(C)C3)n2c1
InChIInChI=1S/C14H19N3O/c1-16-6-5-11(9-16)7-14-15-8-12-3-4-13(18-2)10-17(12)14/h3-4,8,10-11H,5-7,9H2,1-2H3
InChIKeyGRUMDOCVSZEEKA-UHFFFAOYSA-N
XLogP1.84
TPSA29.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-3-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine?
The IUPAC name of 6-methoxy-3-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine (CID 117137929) is 6-methoxy-3-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine.
What is the SMILES notation for 6-methoxy-3-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine?
The canonical SMILES for 6-methoxy-3-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine is COc1ccc2cnc(CC3CCN(C)C3)n2c1.
What is the InChIKey of 6-methoxy-3-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine?
The InChIKey is GRUMDOCVSZEEKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-16-6-5-11(9-16)7-14-15-8-12-3-4-13(18-2)10-17(12)14/h3-4,8,10-11H,5-7,9H2,1-2H3.
What are the key properties of 6-methoxy-3-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine?
6-methoxy-3-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine has a molecular weight of 245.33 g/mol, XLogP of 1.84, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-3-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,5-a]pyridine is sourced from PubChem (CID 117137929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).