(1-methylindol-3-yl)-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone

C18H19N3O2S — CID 131653318

IUPAC(1-methylindol-3-yl)-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone
SMILESCc1nc(C2COCCN2C(=O)c2cn(C)c3ccccc23)cs1
InChIInChI=1S/C18H19N3O2S/c1-12-19-15(11-24-12)17-10-23-8-7-21(17)18(22)14-9-20(2)16-6-4-3-5-13(14)16/h3-6,9,11,17H,7-8,10H2,1-2H3
InChIKeyCQPITYLXWKEBMO-UHFFFAOYSA-N
MW341.44 g/mol
LogP3.16
Rot. Bonds2

About (1-methylindol-3-yl)-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone

(1-methylindol-3-yl)-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone (PubChem CID 131653318) has the molecular formula C18H19N3O2S and a molecular weight of 341.44 g/mol. Its IUPAC name is (1-methylindol-3-yl)-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name(1-methylindol-3-yl)-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone
PubChem CID131653318
Molecular FormulaC18H19N3O2S
Molecular Weight341.44 g/mol
Exact Mass341.12
IUPAC Name(1-methylindol-3-yl)-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone
SMILESCc1nc(C2COCCN2C(=O)c2cn(C)c3ccccc23)cs1
InChIInChI=1S/C18H19N3O2S/c1-12-19-15(11-24-12)17-10-23-8-7-21(17)18(22)14-9-20(2)16-6-4-3-5-13(14)16/h3-6,9,11,17H,7-8,10H2,1-2H3
InChIKeyCQPITYLXWKEBMO-UHFFFAOYSA-N
XLogP3.16
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.44
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (1-methylindol-3-yl)-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone 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 (1-methylindol-3-yl)-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone?
The IUPAC name of (1-methylindol-3-yl)-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone (CID 131653318) is (1-methylindol-3-yl)-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone.
What is the SMILES notation for (1-methylindol-3-yl)-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone?
The canonical SMILES for (1-methylindol-3-yl)-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone is Cc1nc(C2COCCN2C(=O)c2cn(C)c3ccccc23)cs1.
What is the InChIKey of (1-methylindol-3-yl)-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone?
The InChIKey is CQPITYLXWKEBMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2S/c1-12-19-15(11-24-12)17-10-23-8-7-21(17)18(22)14-9-20(2)16-6-4-3-5-13(14)16/h3-6,9,11,17H,7-8,10H2,1-2H3.
What are the key properties of (1-methylindol-3-yl)-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone?
(1-methylindol-3-yl)-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone has a molecular weight of 341.44 g/mol, XLogP of 3.16, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylindol-3-yl)-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]methanone is sourced from PubChem (CID 131653318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).