N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-2-(2-methylphenyl)acetamide

C19H25N3O2S — CID 51321385

IUPACN-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-2-(2-methylphenyl)acetamide
SMILESCc1ccccc1CC(=O)Nc1nc(CN2CC(C)OC(C)C2)cs1
InChIInChI=1S/C19H25N3O2S/c1-13-6-4-5-7-16(13)8-18(23)21-19-20-17(12-25-19)11-22-9-14(2)24-15(3)10-22/h4-7,12,14-15H,8-11H2,1-3H3,(H,20,21,23)
InChIKeyQGFXGHSMUGRQDB-UHFFFAOYSA-N
MW359.50 g/mol
LogP3.24
Rot. Bonds5

About N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-2-(2-methylphenyl)acetamide

N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-2-(2-methylphenyl)acetamide (PubChem CID 51321385) has the molecular formula C19H25N3O2S and a molecular weight of 359.50 g/mol. Its IUPAC name is N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-2-(2-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-2-(2-methylphenyl)acetamide
PubChem CID51321385
Molecular FormulaC19H25N3O2S
Molecular Weight359.50 g/mol
Exact Mass359.17
IUPAC NameN-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-2-(2-methylphenyl)acetamide
SMILESCc1ccccc1CC(=O)Nc1nc(CN2CC(C)OC(C)C2)cs1
InChIInChI=1S/C19H25N3O2S/c1-13-6-4-5-7-16(13)8-18(23)21-19-20-17(12-25-19)11-22-9-14(2)24-15(3)10-22/h4-7,12,14-15H,8-11H2,1-3H3,(H,20,21,23)
InChIKeyQGFXGHSMUGRQDB-UHFFFAOYSA-N
XLogP3.24
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.50
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

H3B-120
CID 132355378
(2S)-2-[(1-methylpiperidin-2-yl)formamido]-8-oxo-N-(4-phenyl-1,3-thiazol-2-yl)nonanamide
CID 16036765
2-Morpholino-N-(4-phenylthiazol-2-yl)acetamide
CID 783107
N-[(1R)-2-oxo-1-phenyl-2-[(2S)-2-[(4-phenyl-1,3-thiazol-2-yl)carbamoyl]pyrrolidin-1-yl]ethyl]morpholine-4-carboxamide
CID 137643823
2-Morpholino-N-(4-(p-tolyl)thiazol-2-yl)acetamide
CID 2336901
N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-(4-morpholinyl)acetamide
CID 6468522
2-((2-morpholino-2-oxoethyl)thio)-N-(4-phenylthiazol-2-yl)acetamide
CID 2158825
N-(4-methyl-1,3-thiazol-2-yl)-3-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 2506795
2-ethylsulfonyl-N-(4-methyl-1,3-thiazol-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide
CID 3948495
N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-phenylbenzamide
CID 31962491
(2S)-2-[(1-methylpiperidin-2-yl)amino]-8-oxo-N-(4-phenyl-1,3-thiazol-2-yl)nonanamide
CID 44456965
N-[(2R)-3-methyl-1-oxo-1-[(2S)-2-[(4-phenyl-1,3-thiazol-2-yl)carbamoyl]pyrrolidin-1-yl]butan-2-yl]morpholine-4-carboxamide
CID 137650299

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-2-(2-methylphenyl)acetamide?
The IUPAC name of N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-2-(2-methylphenyl)acetamide (CID 51321385) is N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-2-(2-methylphenyl)acetamide.
What is the SMILES notation for N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-2-(2-methylphenyl)acetamide?
The canonical SMILES for N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-2-(2-methylphenyl)acetamide is Cc1ccccc1CC(=O)Nc1nc(CN2CC(C)OC(C)C2)cs1.
What is the InChIKey of N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-2-(2-methylphenyl)acetamide?
The InChIKey is QGFXGHSMUGRQDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2S/c1-13-6-4-5-7-16(13)8-18(23)21-19-20-17(12-25-19)11-22-9-14(2)24-15(3)10-22/h4-7,12,14-15H,8-11H2,1-3H3,(H,20,21,23).
What are the key properties of N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-2-(2-methylphenyl)acetamide?
N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-2-(2-methylphenyl)acetamide has a molecular weight of 359.50 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-2-(2-methylphenyl)acetamide is sourced from PubChem (CID 51321385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).