5-amino-N-[4-(hydroxymethyl)oxan-4-yl]-3-methylimidazole-4-sulfonamide

C10H18N4O4S — CID 106296705

IUPAC5-amino-N-[4-(hydroxymethyl)oxan-4-yl]-3-methylimidazole-4-sulfonamide
SMILESCn1cnc(N)c1S(=O)(=O)NC1(CO)CCOCC1
InChIInChI=1S/C10H18N4O4S/c1-14-7-12-8(11)9(14)19(16,17)13-10(6-15)2-4-18-5-3-10/h7,13,15H,2-6,11H2,1H3
InChIKeyRPXJDSWEQJACCG-UHFFFAOYSA-N
MW290.34 g/mol
LogP-1.18
Rot. Bonds4

About 5-amino-N-[4-(hydroxymethyl)oxan-4-yl]-3-methylimidazole-4-sulfonamide

5-amino-N-[4-(hydroxymethyl)oxan-4-yl]-3-methylimidazole-4-sulfonamide (PubChem CID 106296705) has the molecular formula C10H18N4O4S and a molecular weight of 290.34 g/mol. Its IUPAC name is 5-amino-N-[4-(hydroxymethyl)oxan-4-yl]-3-methylimidazole-4-sulfonamide.

Molecular Properties

Compound Name5-amino-N-[4-(hydroxymethyl)oxan-4-yl]-3-methylimidazole-4-sulfonamide
PubChem CID106296705
Molecular FormulaC10H18N4O4S
Molecular Weight290.34 g/mol
Exact Mass290.10
IUPAC Name5-amino-N-[4-(hydroxymethyl)oxan-4-yl]-3-methylimidazole-4-sulfonamide
SMILESCn1cnc(N)c1S(=O)(=O)NC1(CO)CCOCC1
InChIInChI=1S/C10H18N4O4S/c1-14-7-12-8(11)9(14)19(16,17)13-10(6-15)2-4-18-5-3-10/h7,13,15H,2-6,11H2,1H3
InChIKeyRPXJDSWEQJACCG-UHFFFAOYSA-N
XLogP-1.18
TPSA119.47 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 5-1.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

5-amino-3-methyl-N-(2-morpholin-4-ylethyl)imidazole-4-sulfonamide
CID 63977723
4-[[4-(hydroxymethyl)oxan-4-yl]sulfamoyl]-1-methylpyrrole-2-carboxamide
CID 106298992
4-amino-2,6-dichloro-N-[4-(hydroxymethyl)oxan-4-yl]benzenesulfonamide
CID 106296782
5-amino-2-fluoro-N-[4-(hydroxymethyl)oxan-4-yl]-4-methylbenzenesulfonamide
CID 106296774
3-amino-N-[4-(hydroxymethyl)oxan-4-yl]-4,5-dimethylbenzenesulfonamide
CID 106296708
5-amino-3-methyl-N-phenylimidazole-4-sulfonamide;hydrochloride
CID 54601102
2-[(5-amino-3-methylimidazol-4-yl)sulfonylamino]acetamide
CID 63977708
3-amino-4-fluoro-N-[4-(hydroxymethyl)oxan-4-yl]-5-methylbenzenesulfonamide
CID 106296764
5-amino-3-methyl-N-(2-methylprop-2-enyl)imidazole-4-sulfonamide
CID 114615039
4-acetyl-N-[4-(hydroxymethyl)oxan-4-yl]benzenesulfonamide
CID 106299081
5-amino-3-methyl-N-pentan-3-ylimidazole-4-sulfonamide
CID 63977514
5-amino-N-(3-hydroxybutyl)-3-methylimidazole-4-sulfonamide
CID 64929209

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[4-(hydroxymethyl)oxan-4-yl]-3-methylimidazole-4-sulfonamide?
The IUPAC name of 5-amino-N-[4-(hydroxymethyl)oxan-4-yl]-3-methylimidazole-4-sulfonamide (CID 106296705) is 5-amino-N-[4-(hydroxymethyl)oxan-4-yl]-3-methylimidazole-4-sulfonamide.
What is the SMILES notation for 5-amino-N-[4-(hydroxymethyl)oxan-4-yl]-3-methylimidazole-4-sulfonamide?
The canonical SMILES for 5-amino-N-[4-(hydroxymethyl)oxan-4-yl]-3-methylimidazole-4-sulfonamide is Cn1cnc(N)c1S(=O)(=O)NC1(CO)CCOCC1.
What is the InChIKey of 5-amino-N-[4-(hydroxymethyl)oxan-4-yl]-3-methylimidazole-4-sulfonamide?
The InChIKey is RPXJDSWEQJACCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O4S/c1-14-7-12-8(11)9(14)19(16,17)13-10(6-15)2-4-18-5-3-10/h7,13,15H,2-6,11H2,1H3.
What are the key properties of 5-amino-N-[4-(hydroxymethyl)oxan-4-yl]-3-methylimidazole-4-sulfonamide?
5-amino-N-[4-(hydroxymethyl)oxan-4-yl]-3-methylimidazole-4-sulfonamide has a molecular weight of 290.34 g/mol, XLogP of -1.18, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[4-(hydroxymethyl)oxan-4-yl]-3-methylimidazole-4-sulfonamide is sourced from PubChem (CID 106296705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).