N-(4-methoxyphenyl)-1H-imidazole-5-sulfonamide

C10H11N3O3S — CID 4670203

IUPACN-(4-methoxyphenyl)-1H-imidazole-5-sulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2cnc[nH]2)cc1
InChIInChI=1S/C10H11N3O3S/c1-16-9-4-2-8(3-5-9)13-17(14,15)10-6-11-7-12-10/h2-7,13H,1H3,(H,11,12)
InChIKeyQYVUJDGVSUCUCW-UHFFFAOYSA-N
MW253.28 g/mol
LogP1.22
Rot. Bonds4

About N-(4-methoxyphenyl)-1H-imidazole-5-sulfonamide

N-(4-methoxyphenyl)-1H-imidazole-5-sulfonamide (PubChem CID 4670203) has the molecular formula C10H11N3O3S and a molecular weight of 253.28 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-1H-imidazole-5-sulfonamide
PubChem CID4670203
Molecular FormulaC10H11N3O3S
Molecular Weight253.28 g/mol
Exact Mass253.05
IUPAC NameN-(4-methoxyphenyl)-1H-imidazole-5-sulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2cnc[nH]2)cc1
InChIInChI=1S/C10H11N3O3S/c1-16-9-4-2-8(3-5-9)13-17(14,15)10-6-11-7-12-10/h2-7,13H,1H3,(H,11,12)
InChIKeyQYVUJDGVSUCUCW-UHFFFAOYSA-N
XLogP1.22
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.28
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-1H-imidazole-5-sulfonamide?
The IUPAC name of N-(4-methoxyphenyl)-1H-imidazole-5-sulfonamide (CID 4670203) is N-(4-methoxyphenyl)-1H-imidazole-5-sulfonamide.
What is the SMILES notation for N-(4-methoxyphenyl)-1H-imidazole-5-sulfonamide?
The canonical SMILES for N-(4-methoxyphenyl)-1H-imidazole-5-sulfonamide is COc1ccc(NS(=O)(=O)c2cnc[nH]2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-1H-imidazole-5-sulfonamide?
The InChIKey is QYVUJDGVSUCUCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O3S/c1-16-9-4-2-8(3-5-9)13-17(14,15)10-6-11-7-12-10/h2-7,13H,1H3,(H,11,12).
What are the key properties of N-(4-methoxyphenyl)-1H-imidazole-5-sulfonamide?
N-(4-methoxyphenyl)-1H-imidazole-5-sulfonamide has a molecular weight of 253.28 g/mol, XLogP of 1.22, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 4670203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).