2-morpholin-4-yl-4-[2-oxo-2-[(2R)-2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxamide

C19H22N4O3S — CID 57410173

IUPAC2-morpholin-4-yl-4-[2-oxo-2-[(2R)-2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxamide
SMILES[2H]C([2H])([2H])[C@@H]1Cc2ccccc2N1C(=O)Cc1nc(N2CCOCC2)sc1C(N)=O
InChIInChI=1S/C19H22N4O3S/c1-12-10-13-4-2-3-5-15(13)23(12)16(24)11-14-17(18(20)25)27-19(21-14)22-6-8-26-9-7-22/h2-5,12H,6-11H2,1H3,(H2,20,25)/t12-/m1/s1/i1D3
InChIKeyOCROPRWMXRKQMD-LBBMYNEISA-N
MW389.50 g/mol
LogP1.60
Rot. Bonds5

About 2-morpholin-4-yl-4-[2-oxo-2-[(2R)-2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxamide

2-morpholin-4-yl-4-[2-oxo-2-[(2R)-2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxamide (PubChem CID 57410173) has the molecular formula C19H22N4O3S and a molecular weight of 389.50 g/mol. Its IUPAC name is 2-morpholin-4-yl-4-[2-oxo-2-[(2R)-2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-morpholin-4-yl-4-[2-oxo-2-[(2R)-2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxamide
PubChem CID57410173
Molecular FormulaC19H22N4O3S
Molecular Weight389.50 g/mol
Exact Mass389.16
IUPAC Name2-morpholin-4-yl-4-[2-oxo-2-[(2R)-2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxamide
SMILES[2H]C([2H])([2H])[C@@H]1Cc2ccccc2N1C(=O)Cc1nc(N2CCOCC2)sc1C(N)=O
InChIInChI=1S/C19H22N4O3S/c1-12-10-13-4-2-3-5-15(13)23(12)16(24)11-14-17(18(20)25)27-19(21-14)22-6-8-26-9-7-22/h2-5,12H,6-11H2,1H3,(H2,20,25)/t12-/m1/s1/i1D3
InChIKeyOCROPRWMXRKQMD-LBBMYNEISA-N
XLogP1.60
TPSA88.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.50
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-morpholin-4-yl-4-[2-oxo-2-[(2R)-2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxamide 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 2-morpholin-4-yl-4-[2-oxo-2-[(2R)-2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-morpholin-4-yl-4-[2-oxo-2-[(2R)-2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxamide (CID 57410173) is 2-morpholin-4-yl-4-[2-oxo-2-[(2R)-2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-morpholin-4-yl-4-[2-oxo-2-[(2R)-2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-morpholin-4-yl-4-[2-oxo-2-[(2R)-2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxamide is [2H]C([2H])([2H])[C@@H]1Cc2ccccc2N1C(=O)Cc1nc(N2CCOCC2)sc1C(N)=O.
What is the InChIKey of 2-morpholin-4-yl-4-[2-oxo-2-[(2R)-2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxamide?
The InChIKey is OCROPRWMXRKQMD-LBBMYNEISA-N. The full InChI is InChI=1S/C19H22N4O3S/c1-12-10-13-4-2-3-5-15(13)23(12)16(24)11-14-17(18(20)25)27-19(21-14)22-6-8-26-9-7-22/h2-5,12H,6-11H2,1H3,(H2,20,25)/t12-/m1/s1/i1D3.
What are the key properties of 2-morpholin-4-yl-4-[2-oxo-2-[(2R)-2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxamide?
2-morpholin-4-yl-4-[2-oxo-2-[(2R)-2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxamide has a molecular weight of 389.50 g/mol, XLogP of 1.60, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-4-[2-oxo-2-[(2R)-2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 57410173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).