2-ethyl-N-(5-iodo-2-pyridinyl)-1H-imidazole-5-sulfonamide

C10H11IN4O2S — CID 65098522

IUPAC2-ethyl-N-(5-iodo-2-pyridinyl)-1H-imidazole-5-sulfonamide
SMILESCCc1ncc(S(=O)(=O)Nc2ccc(I)cn2)[nH]1
InChIInChI=1S/C10H11IN4O2S/c1-2-8-13-6-10(14-8)18(16,17)15-9-4-3-7(11)5-12-9/h3-6H,2H2,1H3,(H,12,15)(H,13,14)
InChIKeyWINVMWXCKKKKIP-UHFFFAOYSA-N
MW378.20 g/mol
LogP1.77
Rot. Bonds4

About 2-ethyl-N-(5-iodo-2-pyridinyl)-1H-imidazole-5-sulfonamide

2-ethyl-N-(5-iodo-2-pyridinyl)-1H-imidazole-5-sulfonamide (PubChem CID 65098522) has the molecular formula C10H11IN4O2S and a molecular weight of 378.20 g/mol. Its IUPAC name is 2-ethyl-N-(5-iodo-2-pyridinyl)-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound Name2-ethyl-N-(5-iodo-2-pyridinyl)-1H-imidazole-5-sulfonamide
PubChem CID65098522
Molecular FormulaC10H11IN4O2S
Molecular Weight378.20 g/mol
Exact Mass377.96
IUPAC Name2-ethyl-N-(5-iodo-2-pyridinyl)-1H-imidazole-5-sulfonamide
SMILESCCc1ncc(S(=O)(=O)Nc2ccc(I)cn2)[nH]1
InChIInChI=1S/C10H11IN4O2S/c1-2-8-13-6-10(14-8)18(16,17)15-9-4-3-7(11)5-12-9/h3-6H,2H2,1H3,(H,12,15)(H,13,14)
InChIKeyWINVMWXCKKKKIP-UHFFFAOYSA-N
XLogP1.77
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.20
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

1-(1H-imidazol-5-ylsulfonyl)-4-phenylpiperazine
CID 11957294
1-(4-fluorophenyl)-4-(1H-imidazol-4-ylsulfonyl)piperazine
CID 16195463
N-ethyl-N-phenyl-1H-imidazole-4-sulfonamide
CID 3237381
Imidazo(1,2-a)pyridine-3-sulfonamide
CID 14422439
6-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-3-pyridinesulfonamide
CID 902035
N-[2-(1-methylimidazol-2-yl)ethyl]pyridine-3-sulfonamide
CID 47084788
N-[[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]methyl]pyridine-3-sulfonamide
CID 56756784
1-butan-2-yl-N-[2-(dimethylamino)-3-pyridinyl]-N-methylimidazole-4-sulfonamide
CID 71918931
N-(2,5-difluorophenyl)-N-methyl-2-propan-2-yl-1H-imidazole-5-sulfonamide
CID 71981424
N-(4-fluorophenyl)-N-methyl-2-propan-2-yl-1H-imidazole-5-sulfonamide
CID 71998233
N-(6-(2-methyl-1H-imidazol-1-yl)pyridin-3-yl)pyridine-3-sulfonamide
CID 72021845
1-[(1-Methyl-1H-imidazol-4-YL)sulfonyl]-4-(2-pyridyl)piperazine
CID 2813156

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(5-iodo-2-pyridinyl)-1H-imidazole-5-sulfonamide?
The IUPAC name of 2-ethyl-N-(5-iodo-2-pyridinyl)-1H-imidazole-5-sulfonamide (CID 65098522) is 2-ethyl-N-(5-iodo-2-pyridinyl)-1H-imidazole-5-sulfonamide.
What is the SMILES notation for 2-ethyl-N-(5-iodo-2-pyridinyl)-1H-imidazole-5-sulfonamide?
The canonical SMILES for 2-ethyl-N-(5-iodo-2-pyridinyl)-1H-imidazole-5-sulfonamide is CCc1ncc(S(=O)(=O)Nc2ccc(I)cn2)[nH]1.
What is the InChIKey of 2-ethyl-N-(5-iodo-2-pyridinyl)-1H-imidazole-5-sulfonamide?
The InChIKey is WINVMWXCKKKKIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11IN4O2S/c1-2-8-13-6-10(14-8)18(16,17)15-9-4-3-7(11)5-12-9/h3-6H,2H2,1H3,(H,12,15)(H,13,14).
What are the key properties of 2-ethyl-N-(5-iodo-2-pyridinyl)-1H-imidazole-5-sulfonamide?
2-ethyl-N-(5-iodo-2-pyridinyl)-1H-imidazole-5-sulfonamide has a molecular weight of 378.20 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(5-iodo-2-pyridinyl)-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 65098522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).