[3-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-8-methylimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone

C20H28N4O3 — CID 45194769

IUPAC[3-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-8-methylimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone
SMILESCOCC1CCN(Cc2c(C(=O)N3CCOCC3)nc3c(C)cccn23)C1
InChIInChI=1S/C20H28N4O3/c1-15-4-3-6-24-17(13-22-7-5-16(12-22)14-26-2)18(21-19(15)24)20(25)23-8-10-27-11-9-23/h3-4,6,16H,5,7-14H2,1-2H3
InChIKeyLPGIRULKBFGIDR-UHFFFAOYSA-N
MW372.47 g/mol
LogP1.58
Rot. Bonds5

About [3-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-8-methylimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone

[3-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-8-methylimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone (PubChem CID 45194769) has the molecular formula C20H28N4O3 and a molecular weight of 372.47 g/mol. Its IUPAC name is [3-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-8-methylimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[3-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-8-methylimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone
PubChem CID45194769
Molecular FormulaC20H28N4O3
Molecular Weight372.47 g/mol
Exact Mass372.22
IUPAC Name[3-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-8-methylimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone
SMILESCOCC1CCN(Cc2c(C(=O)N3CCOCC3)nc3c(C)cccn23)C1
InChIInChI=1S/C20H28N4O3/c1-15-4-3-6-24-17(13-22-7-5-16(12-22)14-26-2)18(21-19(15)24)20(25)23-8-10-27-11-9-23/h3-4,6,16H,5,7-14H2,1-2H3
InChIKeyLPGIRULKBFGIDR-UHFFFAOYSA-N
XLogP1.58
TPSA59.31 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze [3-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-8-methylimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [3-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-8-methylimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone?
The IUPAC name of [3-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-8-methylimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone (CID 45194769) is [3-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-8-methylimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [3-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-8-methylimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [3-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-8-methylimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone is COCC1CCN(Cc2c(C(=O)N3CCOCC3)nc3c(C)cccn23)C1.
What is the InChIKey of [3-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-8-methylimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone?
The InChIKey is LPGIRULKBFGIDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O3/c1-15-4-3-6-24-17(13-22-7-5-16(12-22)14-26-2)18(21-19(15)24)20(25)23-8-10-27-11-9-23/h3-4,6,16H,5,7-14H2,1-2H3.
What are the key properties of [3-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-8-methylimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone?
[3-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-8-methylimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone has a molecular weight of 372.47 g/mol, XLogP of 1.58, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-8-methylimidazo[1,2-a]pyridin-2-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 45194769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).