5-amino-N-cyclobutyl-N-(3-hydroxypropyl)-3-methylimidazole-4-sulfonamide

C11H20N4O3S — CID 102859015

IUPAC5-amino-N-cyclobutyl-N-(3-hydroxypropyl)-3-methylimidazole-4-sulfonamide
SMILESCn1cnc(N)c1S(=O)(=O)N(CCCO)C1CCC1
InChIInChI=1S/C11H20N4O3S/c1-14-8-13-10(12)11(14)19(17,18)15(6-3-7-16)9-4-2-5-9/h8-9,16H,2-7,12H2,1H3
InChIKeyQYVAYPBHMZUJKL-UHFFFAOYSA-N
MW288.37 g/mol
LogP-0.07
Rot. Bonds6

About 5-amino-N-cyclobutyl-N-(3-hydroxypropyl)-3-methylimidazole-4-sulfonamide

5-amino-N-cyclobutyl-N-(3-hydroxypropyl)-3-methylimidazole-4-sulfonamide (PubChem CID 102859015) has the molecular formula C11H20N4O3S and a molecular weight of 288.37 g/mol. Its IUPAC name is 5-amino-N-cyclobutyl-N-(3-hydroxypropyl)-3-methylimidazole-4-sulfonamide.

Molecular Properties

Compound Name5-amino-N-cyclobutyl-N-(3-hydroxypropyl)-3-methylimidazole-4-sulfonamide
PubChem CID102859015
Molecular FormulaC11H20N4O3S
Molecular Weight288.37 g/mol
Exact Mass288.13
IUPAC Name5-amino-N-cyclobutyl-N-(3-hydroxypropyl)-3-methylimidazole-4-sulfonamide
SMILESCn1cnc(N)c1S(=O)(=O)N(CCCO)C1CCC1
InChIInChI=1S/C11H20N4O3S/c1-14-8-13-10(12)11(14)19(17,18)15(6-3-7-16)9-4-2-5-9/h8-9,16H,2-7,12H2,1H3
InChIKeyQYVAYPBHMZUJKL-UHFFFAOYSA-N
XLogP-0.07
TPSA101.45 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-amino-N-cyclopentyl-N,3-dimethylimidazole-4-sulfonamide
CID 63978307
5-amino-N-benzyl-N-cyclopropyl-3-methylimidazole-4-sulfonamide
CID 63979084
N-cyclobutyl-1-ethyl-N-(3-hydroxypropyl)imidazole-4-sulfonamide
CID 102847487
N-cyclobutyl-N-(3-hydroxypropyl)-2-methylpyrazole-3-sulfonamide
CID 102847530
5-amino-N-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)imidazole-4-sulfonamide
CID 63980416
N-(3-aminopropyl)-N-cyclopentyl-1-methylimidazole-4-sulfonamide
CID 62374937
3-amino-N-cyclobutyl-N-(3-hydroxypropyl)-4,5-dimethylbenzenesulfonamide
CID 102859099
5-amino-N-(1-hydroxypropan-2-yl)-N,3-dimethylimidazole-4-sulfonamide
CID 104551001
N-cyclobutyl-N-(3-hydroxypropyl)ethanesulfonamide
CID 102847467
N-[5-[cyclobutyl(3-hydroxypropyl)sulfamoyl]-1,3,4-thiadiazol-2-yl]acetamide
CID 102867499
5-amino-N-ethyl-3-methyl-N-(oxolan-3-ylmethyl)imidazole-4-sulfonamide
CID 63980414
5-amino-N,3-dimethyl-N-(3-methylsulfanylpropyl)imidazole-4-sulfonamide
CID 114236541

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-cyclobutyl-N-(3-hydroxypropyl)-3-methylimidazole-4-sulfonamide?
The IUPAC name of 5-amino-N-cyclobutyl-N-(3-hydroxypropyl)-3-methylimidazole-4-sulfonamide (CID 102859015) is 5-amino-N-cyclobutyl-N-(3-hydroxypropyl)-3-methylimidazole-4-sulfonamide.
What is the SMILES notation for 5-amino-N-cyclobutyl-N-(3-hydroxypropyl)-3-methylimidazole-4-sulfonamide?
The canonical SMILES for 5-amino-N-cyclobutyl-N-(3-hydroxypropyl)-3-methylimidazole-4-sulfonamide is Cn1cnc(N)c1S(=O)(=O)N(CCCO)C1CCC1.
What is the InChIKey of 5-amino-N-cyclobutyl-N-(3-hydroxypropyl)-3-methylimidazole-4-sulfonamide?
The InChIKey is QYVAYPBHMZUJKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O3S/c1-14-8-13-10(12)11(14)19(17,18)15(6-3-7-16)9-4-2-5-9/h8-9,16H,2-7,12H2,1H3.
What are the key properties of 5-amino-N-cyclobutyl-N-(3-hydroxypropyl)-3-methylimidazole-4-sulfonamide?
5-amino-N-cyclobutyl-N-(3-hydroxypropyl)-3-methylimidazole-4-sulfonamide has a molecular weight of 288.37 g/mol, XLogP of -0.07, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-cyclobutyl-N-(3-hydroxypropyl)-3-methylimidazole-4-sulfonamide is sourced from PubChem (CID 102859015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).