N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-1,2-dimethylimidazole-4-sulfonamide

C14H21N7O4S — CID 122253920

IUPACN-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-1,2-dimethylimidazole-4-sulfonamide
SMILESCOc1nc(CNS(=O)(=O)c2cn(C)c(C)n2)nc(N2CCOCC2)n1
InChIInChI=1S/C14H21N7O4S/c1-10-16-12(9-20(10)2)26(22,23)15-8-11-17-13(19-14(18-11)24-3)21-4-6-25-7-5-21/h9,15H,4-8H2,1-3H3
InChIKeyXCYWRRRIDIIICS-UHFFFAOYSA-N
MW383.43 g/mol
LogP-0.76
Rot. Bonds6

About N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-1,2-dimethylimidazole-4-sulfonamide

N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-1,2-dimethylimidazole-4-sulfonamide (PubChem CID 122253920) has the molecular formula C14H21N7O4S and a molecular weight of 383.43 g/mol. Its IUPAC name is N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-1,2-dimethylimidazole-4-sulfonamide.

Molecular Properties

Compound NameN-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-1,2-dimethylimidazole-4-sulfonamide
PubChem CID122253920
Molecular FormulaC14H21N7O4S
Molecular Weight383.43 g/mol
Exact Mass383.14
IUPAC NameN-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-1,2-dimethylimidazole-4-sulfonamide
SMILESCOc1nc(CNS(=O)(=O)c2cn(C)c(C)n2)nc(N2CCOCC2)n1
InChIInChI=1S/C14H21N7O4S/c1-10-16-12(9-20(10)2)26(22,23)15-8-11-17-13(19-14(18-11)24-3)21-4-6-25-7-5-21/h9,15H,4-8H2,1-3H3
InChIKeyXCYWRRRIDIIICS-UHFFFAOYSA-N
XLogP-0.76
TPSA124.36 Ų
H-Bond Donors1
H-Bond Acceptors10
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.43
LogP ≤ 5-0.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1010

Analyze N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-1,2-dimethylimidazole-4-sulfonamide with MolForge

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Launch Full Analysis

Related Compounds

4-fluoro-N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-2-methylbenzenesulfonamide
CID 121137821
N-[[5-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methylsulfamoyl]thiophen-2-yl]methyl]acetamide
CID 122253924
N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-3-methyl-2-oxo-1,3-benzoxazole-5-sulfonamide
CID 122253910
N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]oxane-4-carboxamide
CID 122253832
N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-3-(trifluoromethyl)benzenesulfonamide
CID 122253774
N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-1-methyltriazole-4-carboxamide
CID 121137782
N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 122253837
N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]-1-methyl-2-propan-2-ylimidazole-4-sulfonamide
CID 122252856
1-methyl-N-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]-2-propan-2-ylimidazole-4-sulfonamide
CID 122319238
5-acetyl-N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]thiophene-2-carboxamide
CID 122253859
N-[(4-methoxy-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)methyl]methanesulfonamide
CID 119099627
3,4-dimethoxy-N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]benzamide
CID 122253694

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-1,2-dimethylimidazole-4-sulfonamide?
The IUPAC name of N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-1,2-dimethylimidazole-4-sulfonamide (CID 122253920) is N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-1,2-dimethylimidazole-4-sulfonamide.
What is the SMILES notation for N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-1,2-dimethylimidazole-4-sulfonamide?
The canonical SMILES for N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-1,2-dimethylimidazole-4-sulfonamide is COc1nc(CNS(=O)(=O)c2cn(C)c(C)n2)nc(N2CCOCC2)n1.
What is the InChIKey of N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-1,2-dimethylimidazole-4-sulfonamide?
The InChIKey is XCYWRRRIDIIICS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N7O4S/c1-10-16-12(9-20(10)2)26(22,23)15-8-11-17-13(19-14(18-11)24-3)21-4-6-25-7-5-21/h9,15H,4-8H2,1-3H3.
What are the key properties of N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-1,2-dimethylimidazole-4-sulfonamide?
N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-1,2-dimethylimidazole-4-sulfonamide has a molecular weight of 383.43 g/mol, XLogP of -0.76, 6 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)methyl]-1,2-dimethylimidazole-4-sulfonamide is sourced from PubChem (CID 122253920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).