5,5-dimethyl-3-[2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]ethyl]imidazolidine-2,4-dione

C15H22N4O3S — CID 95137115

IUPAC5,5-dimethyl-3-[2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]ethyl]imidazolidine-2,4-dione
SMILESCc1csc([C@@H]2CN(CCN3C(=O)NC(C)(C)C3=O)CCO2)n1
InChIInChI=1S/C15H22N4O3S/c1-10-9-23-12(16-10)11-8-18(6-7-22-11)4-5-19-13(20)15(2,3)17-14(19)21/h9,11H,4-8H2,1-3H3,(H,17,21)/t11-/m0/s1
InChIKeyPCHAILXOMZUUCG-NSHDSACASA-N
MW338.43 g/mol
LogP1.16
Rot. Bonds4

About 5,5-dimethyl-3-[2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]ethyl]imidazolidine-2,4-dione

5,5-dimethyl-3-[2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]ethyl]imidazolidine-2,4-dione (PubChem CID 95137115) has the molecular formula C15H22N4O3S and a molecular weight of 338.43 g/mol. Its IUPAC name is 5,5-dimethyl-3-[2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]ethyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5,5-dimethyl-3-[2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]ethyl]imidazolidine-2,4-dione
PubChem CID95137115
Molecular FormulaC15H22N4O3S
Molecular Weight338.43 g/mol
Exact Mass338.14
IUPAC Name5,5-dimethyl-3-[2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]ethyl]imidazolidine-2,4-dione
SMILESCc1csc([C@@H]2CN(CCN3C(=O)NC(C)(C)C3=O)CCO2)n1
InChIInChI=1S/C15H22N4O3S/c1-10-9-23-12(16-10)11-8-18(6-7-22-11)4-5-19-13(20)15(2,3)17-14(19)21/h9,11H,4-8H2,1-3H3,(H,17,21)/t11-/m0/s1
InChIKeyPCHAILXOMZUUCG-NSHDSACASA-N
XLogP1.16
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.43
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

2-(4-methyl-1,3-thiazol-2-yl)-4-[3-(1,2,4-triazol-1-yl)propyl]morpholine
CID 86772824
4-[2-(3,4-difluorophenyl)ethyl]-2-(4-methyl-1,3-thiazol-2-yl)morpholine
CID 136516008
5,5-dimethyl-3-[2-[(2S)-2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]ethyl]imidazolidine-2,4-dione
CID 95285040
(2S)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(4-methyl-1,3-thiazol-2-yl)morpholine
CID 95137666
(2R)-4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-(4-methyl-1,3-thiazol-2-yl)morpholine
CID 95137763
N-(furan-2-ylmethyl)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]acetamide
CID 95137604
(2S)-4-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-(4-methyl-1,3-thiazol-2-yl)morpholine
CID 95136754
(2R)-4-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-2-(4-methyl-1,3-thiazol-2-yl)morpholine
CID 95138390
(1R)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]-1-phenylethanol
CID 95136891
N-(3-methyl-1,2-oxazol-5-yl)-2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]acetamide
CID 95135990
2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)acetamide
CID 95137831
(2S)-2-(4-methyl-1,3-thiazol-2-yl)-4-[(5-phenyl-1,3-oxazol-2-yl)methyl]morpholine
CID 95138964

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-3-[2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]ethyl]imidazolidine-2,4-dione?
The IUPAC name of 5,5-dimethyl-3-[2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]ethyl]imidazolidine-2,4-dione (CID 95137115) is 5,5-dimethyl-3-[2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]ethyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5,5-dimethyl-3-[2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]ethyl]imidazolidine-2,4-dione?
The canonical SMILES for 5,5-dimethyl-3-[2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]ethyl]imidazolidine-2,4-dione is Cc1csc([C@@H]2CN(CCN3C(=O)NC(C)(C)C3=O)CCO2)n1.
What is the InChIKey of 5,5-dimethyl-3-[2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]ethyl]imidazolidine-2,4-dione?
The InChIKey is PCHAILXOMZUUCG-NSHDSACASA-N. The full InChI is InChI=1S/C15H22N4O3S/c1-10-9-23-12(16-10)11-8-18(6-7-22-11)4-5-19-13(20)15(2,3)17-14(19)21/h9,11H,4-8H2,1-3H3,(H,17,21)/t11-/m0/s1.
What are the key properties of 5,5-dimethyl-3-[2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]ethyl]imidazolidine-2,4-dione?
5,5-dimethyl-3-[2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]ethyl]imidazolidine-2,4-dione has a molecular weight of 338.43 g/mol, XLogP of 1.16, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-3-[2-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)morpholin-4-yl]ethyl]imidazolidine-2,4-dione is sourced from PubChem (CID 95137115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).