5-amino-3-methyl-N-(2-morpholin-4-ylethyl)imidazole-4-sulfonamide

C10H19N5O3S — CID 63977723

IUPAC5-amino-3-methyl-N-(2-morpholin-4-ylethyl)imidazole-4-sulfonamide
SMILESCn1cnc(N)c1S(=O)(=O)NCCN1CCOCC1
InChIInChI=1S/C10H19N5O3S/c1-14-8-12-9(11)10(14)19(16,17)13-2-3-15-4-6-18-7-5-15/h8,13H,2-7,11H2,1H3
InChIKeyAZSBZJIWYSAVIO-UHFFFAOYSA-N
MW289.36 g/mol
LogP-1.39
Rot. Bonds5

About 5-amino-3-methyl-N-(2-morpholin-4-ylethyl)imidazole-4-sulfonamide

5-amino-3-methyl-N-(2-morpholin-4-ylethyl)imidazole-4-sulfonamide (PubChem CID 63977723) has the molecular formula C10H19N5O3S and a molecular weight of 289.36 g/mol. Its IUPAC name is 5-amino-3-methyl-N-(2-morpholin-4-ylethyl)imidazole-4-sulfonamide.

Molecular Properties

Compound Name5-amino-3-methyl-N-(2-morpholin-4-ylethyl)imidazole-4-sulfonamide
PubChem CID63977723
Molecular FormulaC10H19N5O3S
Molecular Weight289.36 g/mol
Exact Mass289.12
IUPAC Name5-amino-3-methyl-N-(2-morpholin-4-ylethyl)imidazole-4-sulfonamide
SMILESCn1cnc(N)c1S(=O)(=O)NCCN1CCOCC1
InChIInChI=1S/C10H19N5O3S/c1-14-8-12-9(11)10(14)19(16,17)13-2-3-15-4-6-18-7-5-15/h8,13H,2-7,11H2,1H3
InChIKeyAZSBZJIWYSAVIO-UHFFFAOYSA-N
XLogP-1.39
TPSA102.48 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.36
LogP ≤ 5-1.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-amino-3-methyl-N-(2-morpholin-4-ylethyl)imidazole-4-sulfonamide?
The IUPAC name of 5-amino-3-methyl-N-(2-morpholin-4-ylethyl)imidazole-4-sulfonamide (CID 63977723) is 5-amino-3-methyl-N-(2-morpholin-4-ylethyl)imidazole-4-sulfonamide.
What is the SMILES notation for 5-amino-3-methyl-N-(2-morpholin-4-ylethyl)imidazole-4-sulfonamide?
The canonical SMILES for 5-amino-3-methyl-N-(2-morpholin-4-ylethyl)imidazole-4-sulfonamide is Cn1cnc(N)c1S(=O)(=O)NCCN1CCOCC1.
What is the InChIKey of 5-amino-3-methyl-N-(2-morpholin-4-ylethyl)imidazole-4-sulfonamide?
The InChIKey is AZSBZJIWYSAVIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O3S/c1-14-8-12-9(11)10(14)19(16,17)13-2-3-15-4-6-18-7-5-15/h8,13H,2-7,11H2,1H3.
What are the key properties of 5-amino-3-methyl-N-(2-morpholin-4-ylethyl)imidazole-4-sulfonamide?
5-amino-3-methyl-N-(2-morpholin-4-ylethyl)imidazole-4-sulfonamide has a molecular weight of 289.36 g/mol, XLogP of -1.39, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-methyl-N-(2-morpholin-4-ylethyl)imidazole-4-sulfonamide is sourced from PubChem (CID 63977723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).