N-(4-methyl-1,3-thiazol-2-yl)-2-propan-2-yl-1H-imidazole-5-sulfonamide

C10H14N4O2S2 — CID 56795165

IUPACN-(4-methyl-1,3-thiazol-2-yl)-2-propan-2-yl-1H-imidazole-5-sulfonamide
SMILESCc1csc(NS(=O)(=O)c2cnc(C(C)C)[nH]2)n1
InChIInChI=1S/C10H14N4O2S2/c1-6(2)9-11-4-8(13-9)18(15,16)14-10-12-7(3)5-17-10/h4-6H,1-3H3,(H,11,13)(H,12,14)
InChIKeyLZNRDOSEEWGGBK-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.10
Rot. Bonds4

About N-(4-methyl-1,3-thiazol-2-yl)-2-propan-2-yl-1H-imidazole-5-sulfonamide

N-(4-methyl-1,3-thiazol-2-yl)-2-propan-2-yl-1H-imidazole-5-sulfonamide (PubChem CID 56795165) has the molecular formula C10H14N4O2S2 and a molecular weight of 286.38 g/mol. Its IUPAC name is N-(4-methyl-1,3-thiazol-2-yl)-2-propan-2-yl-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound NameN-(4-methyl-1,3-thiazol-2-yl)-2-propan-2-yl-1H-imidazole-5-sulfonamide
PubChem CID56795165
Molecular FormulaC10H14N4O2S2
Molecular Weight286.38 g/mol
Exact Mass286.06
IUPAC NameN-(4-methyl-1,3-thiazol-2-yl)-2-propan-2-yl-1H-imidazole-5-sulfonamide
SMILESCc1csc(NS(=O)(=O)c2cnc(C(C)C)[nH]2)n1
InChIInChI=1S/C10H14N4O2S2/c1-6(2)9-11-4-8(13-9)18(15,16)14-10-12-7(3)5-17-10/h4-6H,1-3H3,(H,11,13)(H,12,14)
InChIKeyLZNRDOSEEWGGBK-UHFFFAOYSA-N
XLogP2.10
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)-2-propan-2-yl-1H-imidazole-5-sulfonamide?
The IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)-2-propan-2-yl-1H-imidazole-5-sulfonamide (CID 56795165) is N-(4-methyl-1,3-thiazol-2-yl)-2-propan-2-yl-1H-imidazole-5-sulfonamide.
What is the SMILES notation for N-(4-methyl-1,3-thiazol-2-yl)-2-propan-2-yl-1H-imidazole-5-sulfonamide?
The canonical SMILES for N-(4-methyl-1,3-thiazol-2-yl)-2-propan-2-yl-1H-imidazole-5-sulfonamide is Cc1csc(NS(=O)(=O)c2cnc(C(C)C)[nH]2)n1.
What is the InChIKey of N-(4-methyl-1,3-thiazol-2-yl)-2-propan-2-yl-1H-imidazole-5-sulfonamide?
The InChIKey is LZNRDOSEEWGGBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O2S2/c1-6(2)9-11-4-8(13-9)18(15,16)14-10-12-7(3)5-17-10/h4-6H,1-3H3,(H,11,13)(H,12,14).
What are the key properties of N-(4-methyl-1,3-thiazol-2-yl)-2-propan-2-yl-1H-imidazole-5-sulfonamide?
N-(4-methyl-1,3-thiazol-2-yl)-2-propan-2-yl-1H-imidazole-5-sulfonamide has a molecular weight of 286.38 g/mol, XLogP of 2.10, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-1,3-thiazol-2-yl)-2-propan-2-yl-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 56795165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).