4-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide

C19H20F2N4O3S — CID 57410290

IUPAC4-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide
SMILESC[C@@H]1Cc2c(ccc(F)c2F)N1C(=O)Cc1nc(N2CCOCC2)sc1C(N)=O
InChIInChI=1S/C19H20F2N4O3S/c1-10-8-11-14(3-2-12(20)16(11)21)25(10)15(26)9-13-17(18(22)27)29-19(23-13)24-4-6-28-7-5-24/h2-3,10H,4-9H2,1H3,(H2,22,27)/t10-/m1/s1
InChIKeyBJVFEIKWBQTDLZ-SNVBAGLBSA-N
MW422.46 g/mol
LogP1.88
Rot. Bonds4

About 4-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide

4-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide (PubChem CID 57410290) has the molecular formula C19H20F2N4O3S and a molecular weight of 422.46 g/mol. Its IUPAC name is 4-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide
PubChem CID57410290
Molecular FormulaC19H20F2N4O3S
Molecular Weight422.46 g/mol
Exact Mass422.12
IUPAC Name4-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide
SMILESC[C@@H]1Cc2c(ccc(F)c2F)N1C(=O)Cc1nc(N2CCOCC2)sc1C(N)=O
InChIInChI=1S/C19H20F2N4O3S/c1-10-8-11-14(3-2-12(20)16(11)21)25(10)15(26)9-13-17(18(22)27)29-19(23-13)24-4-6-28-7-5-24/h2-3,10H,4-9H2,1H3,(H2,22,27)/t10-/m1/s1
InChIKeyBJVFEIKWBQTDLZ-SNVBAGLBSA-N
XLogP1.88
TPSA88.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.46
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide with MolForge

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Related Compounds

4-[2-[(2R)-4-chloro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide
CID 57410175
2-morpholin-4-yl-4-[2-oxo-2-[(2R)-2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxamide
CID 57410173
4-[2-(5-fluoro-2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxylic acid
CID 57411715
4-[2-(4-chloro-2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxylic acid
CID 57411716
2-[2-[(2S)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-5-fluoro-3-methyl-6-morpholin-4-ylpyrimidin-4-one
CID 57388369
2-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-3H-pyridin-4-one
CID 160884209
2-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-3H-pyridin-4-one;2-[2-[(2S)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-6-morpholin-4-yl-3H-pyridin-4-one
CID 160884208
2-morpholin-4-yl-4-[2-oxo-2-[2-(trideuteriomethyl)-2,3-dihydroindol-1-yl]ethyl]-1,3-thiazole-5-carboxylic acid
CID 57411717
2-morpholin-4-yl-4-propyl-1,3-thiazole-5-carbohydrazide
CID 82433411
2-[2-[(2R)-4-chloro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-3-methyl-6-morpholin-4-ylpyrimidin-4-one;2-[2-[(2S)-4-chloro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-3-methyl-6-morpholin-4-ylpyrimidin-4-one
CID 158374697
4-methyl-2-morpholin-4-yl-N'-(2,3,4-trifluorophenyl)sulfonyl-1,3-thiazole-5-carbohydrazide
CID 26950922
1-[(2R)-4-(difluoromethoxy)-2-methyl-2,3-dihydroindol-1-yl]-2-(4-hydroxy-3-methyl-6-morpholin-4-yl-4H-pyrimidin-2-yl)ethanone
CID 57389945

Frequently Asked Questions

What is the IUPAC name of 4-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide (CID 57410290) is 4-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide is C[C@@H]1Cc2c(ccc(F)c2F)N1C(=O)Cc1nc(N2CCOCC2)sc1C(N)=O.
What is the InChIKey of 4-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide?
The InChIKey is BJVFEIKWBQTDLZ-SNVBAGLBSA-N. The full InChI is InChI=1S/C19H20F2N4O3S/c1-10-8-11-14(3-2-12(20)16(11)21)25(10)15(26)9-13-17(18(22)27)29-19(23-13)24-4-6-28-7-5-24/h2-3,10H,4-9H2,1H3,(H2,22,27)/t10-/m1/s1.
What are the key properties of 4-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide?
4-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide has a molecular weight of 422.46 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(2R)-4,5-difluoro-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-2-morpholin-4-yl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 57410290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).