[1-(5-amino-3-methylimidazol-4-yl)sulfonylazetidin-3-yl]methanol

C8H14N4O3S — CID 107213097

IUPAC[1-(5-amino-3-methylimidazol-4-yl)sulfonylazetidin-3-yl]methanol
SMILESCn1cnc(N)c1S(=O)(=O)N1CC(CO)C1
InChIInChI=1S/C8H14N4O3S/c1-11-5-10-7(9)8(11)16(14,15)12-2-6(3-12)4-13/h5-6,13H,2-4,9H2,1H3
InChIKeyHTEBPOKNTGISSY-UHFFFAOYSA-N
MW246.29 g/mol
LogP-1.38
Rot. Bonds3

About [1-(5-amino-3-methylimidazol-4-yl)sulfonylazetidin-3-yl]methanol

[1-(5-amino-3-methylimidazol-4-yl)sulfonylazetidin-3-yl]methanol (PubChem CID 107213097) has the molecular formula C8H14N4O3S and a molecular weight of 246.29 g/mol. Its IUPAC name is [1-(5-amino-3-methylimidazol-4-yl)sulfonylazetidin-3-yl]methanol.

Molecular Properties

Compound Name[1-(5-amino-3-methylimidazol-4-yl)sulfonylazetidin-3-yl]methanol
PubChem CID107213097
Molecular FormulaC8H14N4O3S
Molecular Weight246.29 g/mol
Exact Mass246.08
IUPAC Name[1-(5-amino-3-methylimidazol-4-yl)sulfonylazetidin-3-yl]methanol
SMILESCn1cnc(N)c1S(=O)(=O)N1CC(CO)C1
InChIInChI=1S/C8H14N4O3S/c1-11-5-10-7(9)8(11)16(14,15)12-2-6(3-12)4-13/h5-6,13H,2-4,9H2,1H3
InChIKeyHTEBPOKNTGISSY-UHFFFAOYSA-N
XLogP-1.38
TPSA101.45 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.29
LogP ≤ 5-1.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze [1-(5-amino-3-methylimidazol-4-yl)sulfonylazetidin-3-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-amino-N-(2,2-difluoro-3-hydroxypropyl)-3-methylimidazole-4-sulfonamide
CID 106165569
1-(5-Amino-3-methylimidazol-4-yl)sulfonylpiperidin-4-ol
CID 63977524
5-amino-N-(3-methoxypropyl)-3-methylimidazole-4-sulfonamide
CID 63977550
5-amino-N-(3-hydroxypropyl)-3-methylimidazole-4-sulfonamide
CID 63977551
5-amino-N-(2-hydroxyethyl)-3-methylimidazole-4-sulfonamide
CID 63977552
5-amino-N-(2-hydroxyethyl)-N,3-dimethylimidazole-4-sulfonamide
CID 63977553
5-amino-N-(1-hydroxybutan-2-yl)-3-methylimidazole-4-sulfonamide
CID 63977555
5-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3-methylimidazole-4-sulfonamide
CID 63977556
5-amino-N-(2-hydroxypropyl)-3-methylimidazole-4-sulfonamide
CID 63977743
5-amino-N-(1-hydroxypropan-2-yl)-3-methylimidazole-4-sulfonamide
CID 63977744
5-amino-N-(3-ethoxypropyl)-3-methylimidazole-4-sulfonamide
CID 63978478
5-amino-N,3-dimethyl-N-propylimidazole-4-sulfonamide
CID 63978496

Frequently Asked Questions

What is the IUPAC name of [1-(5-amino-3-methylimidazol-4-yl)sulfonylazetidin-3-yl]methanol?
The IUPAC name of [1-(5-amino-3-methylimidazol-4-yl)sulfonylazetidin-3-yl]methanol (CID 107213097) is [1-(5-amino-3-methylimidazol-4-yl)sulfonylazetidin-3-yl]methanol.
What is the SMILES notation for [1-(5-amino-3-methylimidazol-4-yl)sulfonylazetidin-3-yl]methanol?
The canonical SMILES for [1-(5-amino-3-methylimidazol-4-yl)sulfonylazetidin-3-yl]methanol is Cn1cnc(N)c1S(=O)(=O)N1CC(CO)C1.
What is the InChIKey of [1-(5-amino-3-methylimidazol-4-yl)sulfonylazetidin-3-yl]methanol?
The InChIKey is HTEBPOKNTGISSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O3S/c1-11-5-10-7(9)8(11)16(14,15)12-2-6(3-12)4-13/h5-6,13H,2-4,9H2,1H3.
What are the key properties of [1-(5-amino-3-methylimidazol-4-yl)sulfonylazetidin-3-yl]methanol?
[1-(5-amino-3-methylimidazol-4-yl)sulfonylazetidin-3-yl]methanol has a molecular weight of 246.29 g/mol, XLogP of -1.38, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-amino-3-methylimidazol-4-yl)sulfonylazetidin-3-yl]methanol is sourced from PubChem (CID 107213097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).