1-(2-methylpropyl)imidazole-4-sulfonamide

C7H13N3O2S — CID 75356295

IUPAC1-(2-methylpropyl)imidazole-4-sulfonamide
SMILESCC(C)Cn1cnc(S(N)(=O)=O)c1
InChIInChI=1S/C7H13N3O2S/c1-6(2)3-10-4-7(9-5-10)13(8,11)12/h4-6H,3H2,1-2H3,(H2,8,11,12)
InChIKeyPEANEMOFABATCG-UHFFFAOYSA-N
MW203.27 g/mol
LogP0.19
Rot. Bonds3

About 1-(2-methylpropyl)imidazole-4-sulfonamide

1-(2-methylpropyl)imidazole-4-sulfonamide (PubChem CID 75356295) has the molecular formula C7H13N3O2S and a molecular weight of 203.27 g/mol. Its IUPAC name is 1-(2-methylpropyl)imidazole-4-sulfonamide.

Molecular Properties

Compound Name1-(2-methylpropyl)imidazole-4-sulfonamide
PubChem CID75356295
Molecular FormulaC7H13N3O2S
Molecular Weight203.27 g/mol
Exact Mass203.07
IUPAC Name1-(2-methylpropyl)imidazole-4-sulfonamide
SMILESCC(C)Cn1cnc(S(N)(=O)=O)c1
InChIInChI=1S/C7H13N3O2S/c1-6(2)3-10-4-7(9-5-10)13(8,11)12/h4-6H,3H2,1-2H3,(H2,8,11,12)
InChIKeyPEANEMOFABATCG-UHFFFAOYSA-N
XLogP0.19
TPSA77.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.27
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropyl)imidazole-4-sulfonamide?
The IUPAC name of 1-(2-methylpropyl)imidazole-4-sulfonamide (CID 75356295) is 1-(2-methylpropyl)imidazole-4-sulfonamide.
What is the SMILES notation for 1-(2-methylpropyl)imidazole-4-sulfonamide?
The canonical SMILES for 1-(2-methylpropyl)imidazole-4-sulfonamide is CC(C)Cn1cnc(S(N)(=O)=O)c1.
What is the InChIKey of 1-(2-methylpropyl)imidazole-4-sulfonamide?
The InChIKey is PEANEMOFABATCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O2S/c1-6(2)3-10-4-7(9-5-10)13(8,11)12/h4-6H,3H2,1-2H3,(H2,8,11,12).
What are the key properties of 1-(2-methylpropyl)imidazole-4-sulfonamide?
1-(2-methylpropyl)imidazole-4-sulfonamide has a molecular weight of 203.27 g/mol, XLogP of 0.19, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropyl)imidazole-4-sulfonamide is sourced from PubChem (CID 75356295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).