N-(2,3-dimethylcyclopentyl)-1H-imidazole-5-sulfonamide

C10H17N3O2S — CID 64923633

IUPACN-(2,3-dimethylcyclopentyl)-1H-imidazole-5-sulfonamide
SMILESCC1CCC(NS(=O)(=O)c2cnc[nH]2)C1C
InChIInChI=1S/C10H17N3O2S/c1-7-3-4-9(8(7)2)13-16(14,15)10-5-11-6-12-10/h5-9,13H,3-4H2,1-2H3,(H,11,12)
InChIKeyLKMGGGWEBGBRMK-UHFFFAOYSA-N
MW243.33 g/mol
LogP1.12
Rot. Bonds3

About N-(2,3-dimethylcyclopentyl)-1H-imidazole-5-sulfonamide

N-(2,3-dimethylcyclopentyl)-1H-imidazole-5-sulfonamide (PubChem CID 64923633) has the molecular formula C10H17N3O2S and a molecular weight of 243.33 g/mol. Its IUPAC name is N-(2,3-dimethylcyclopentyl)-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound NameN-(2,3-dimethylcyclopentyl)-1H-imidazole-5-sulfonamide
PubChem CID64923633
Molecular FormulaC10H17N3O2S
Molecular Weight243.33 g/mol
Exact Mass243.10
IUPAC NameN-(2,3-dimethylcyclopentyl)-1H-imidazole-5-sulfonamide
SMILESCC1CCC(NS(=O)(=O)c2cnc[nH]2)C1C
InChIInChI=1S/C10H17N3O2S/c1-7-3-4-9(8(7)2)13-16(14,15)10-5-11-6-12-10/h5-9,13H,3-4H2,1-2H3,(H,11,12)
InChIKeyLKMGGGWEBGBRMK-UHFFFAOYSA-N
XLogP1.12
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylcyclopentyl)-1H-imidazole-5-sulfonamide?
The IUPAC name of N-(2,3-dimethylcyclopentyl)-1H-imidazole-5-sulfonamide (CID 64923633) is N-(2,3-dimethylcyclopentyl)-1H-imidazole-5-sulfonamide.
What is the SMILES notation for N-(2,3-dimethylcyclopentyl)-1H-imidazole-5-sulfonamide?
The canonical SMILES for N-(2,3-dimethylcyclopentyl)-1H-imidazole-5-sulfonamide is CC1CCC(NS(=O)(=O)c2cnc[nH]2)C1C.
What is the InChIKey of N-(2,3-dimethylcyclopentyl)-1H-imidazole-5-sulfonamide?
The InChIKey is LKMGGGWEBGBRMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2S/c1-7-3-4-9(8(7)2)13-16(14,15)10-5-11-6-12-10/h5-9,13H,3-4H2,1-2H3,(H,11,12).
What are the key properties of N-(2,3-dimethylcyclopentyl)-1H-imidazole-5-sulfonamide?
N-(2,3-dimethylcyclopentyl)-1H-imidazole-5-sulfonamide has a molecular weight of 243.33 g/mol, XLogP of 1.12, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylcyclopentyl)-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 64923633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).