4-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]thiomorpholine

C19H21N3S — CID 3457103

IUPAC4-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]thiomorpholine
SMILESCc1ccc2nc(-c3ccccc3)c(CN3CCSCC3)n2c1
InChIInChI=1S/C19H21N3S/c1-15-7-8-18-20-19(16-5-3-2-4-6-16)17(22(18)13-15)14-21-9-11-23-12-10-21/h2-8,13H,9-12,14H2,1H3
InChIKeyXOSJREHQEMLOML-UHFFFAOYSA-N
MW323.47 g/mol
LogP3.86
Rot. Bonds3

About 4-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]thiomorpholine

4-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]thiomorpholine (PubChem CID 3457103) has the molecular formula C19H21N3S and a molecular weight of 323.47 g/mol. Its IUPAC name is 4-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]thiomorpholine.

Molecular Properties

Compound Name4-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]thiomorpholine
PubChem CID3457103
Molecular FormulaC19H21N3S
Molecular Weight323.47 g/mol
Exact Mass323.15
IUPAC Name4-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]thiomorpholine
SMILESCc1ccc2nc(-c3ccccc3)c(CN3CCSCC3)n2c1
InChIInChI=1S/C19H21N3S/c1-15-7-8-18-20-19(16-5-3-2-4-6-16)17(22(18)13-15)14-21-9-11-23-12-10-21/h2-8,13H,9-12,14H2,1H3
InChIKeyXOSJREHQEMLOML-UHFFFAOYSA-N
XLogP3.86
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.47
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]thiomorpholine?
The IUPAC name of 4-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]thiomorpholine (CID 3457103) is 4-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]thiomorpholine.
What is the SMILES notation for 4-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]thiomorpholine?
The canonical SMILES for 4-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]thiomorpholine is Cc1ccc2nc(-c3ccccc3)c(CN3CCSCC3)n2c1.
What is the InChIKey of 4-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]thiomorpholine?
The InChIKey is XOSJREHQEMLOML-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3S/c1-15-7-8-18-20-19(16-5-3-2-4-6-16)17(22(18)13-15)14-21-9-11-23-12-10-21/h2-8,13H,9-12,14H2,1H3.
What are the key properties of 4-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]thiomorpholine?
4-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]thiomorpholine has a molecular weight of 323.47 g/mol, XLogP of 3.86, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]thiomorpholine is sourced from PubChem (CID 3457103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).