N-(2-cyclopropylpropyl)-2-ethyl-1H-imidazole-5-sulfonamide

C11H19N3O2S — CID 113476004

IUPACN-(2-cyclopropylpropyl)-2-ethyl-1H-imidazole-5-sulfonamide
SMILESCCc1ncc(S(=O)(=O)NCC(C)C2CC2)[nH]1
InChIInChI=1S/C11H19N3O2S/c1-3-10-12-7-11(14-10)17(15,16)13-6-8(2)9-4-5-9/h7-9,13H,3-6H2,1-2H3,(H,12,14)
InChIKeyOWHVZPZGKFVXEE-UHFFFAOYSA-N
MW257.36 g/mol
LogP1.30
Rot. Bonds6

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

N-(2-cyclopropylpropyl)-2-ethyl-1H-imidazole-5-sulfonamide (PubChem CID 113476004) has the molecular formula C11H19N3O2S and a molecular weight of 257.36 g/mol. Its IUPAC name is N-(2-cyclopropylpropyl)-2-ethyl-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound NameN-(2-cyclopropylpropyl)-2-ethyl-1H-imidazole-5-sulfonamide
PubChem CID113476004
Molecular FormulaC11H19N3O2S
Molecular Weight257.36 g/mol
Exact Mass257.12
IUPAC NameN-(2-cyclopropylpropyl)-2-ethyl-1H-imidazole-5-sulfonamide
SMILESCCc1ncc(S(=O)(=O)NCC(C)C2CC2)[nH]1
InChIInChI=1S/C11H19N3O2S/c1-3-10-12-7-11(14-10)17(15,16)13-6-8(2)9-4-5-9/h7-9,13H,3-6H2,1-2H3,(H,12,14)
InChIKeyOWHVZPZGKFVXEE-UHFFFAOYSA-N
XLogP1.30
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.36
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-2-methylpropyl)-2-ethyl-1H-imidazole-5-sulfonamide
CID 65036950
N-(2-bromo-3-ethylpentyl)-2-ethyl-1H-imidazole-5-sulfonamide
CID 106288635
N-[(3-aminocyclobutyl)methyl]-2-ethyl-1H-imidazole-5-sulfonamide
CID 66005194
2-ethyl-N-(2-ethylsulfonylethyl)-1H-imidazole-5-sulfonamide
CID 114111971
N-(2-bromoethyl)-2-ethyl-1H-imidazole-5-sulfonamide
CID 114298250
N-[(3-chlorocyclobutyl)methyl]-2-ethyl-1H-imidazole-5-sulfonamide
CID 66004609
2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]-1H-imidazole-5-sulfonamide
CID 113430471
N-(2-amino-2-methylpropyl)-2-ethyl-1H-imidazole-5-sulfonamide
CID 115303585
2-ethyl-N-[(2-ethylphenyl)methyl]-1H-imidazole-5-sulfonamide
CID 64693083
2-ethyl-N-[(4-methylpiperidin-3-yl)methyl]-1H-imidazole-5-sulfonamide
CID 114955854
N-[[4-(chloromethyl)phenyl]methyl]-2-ethyl-1H-imidazole-5-sulfonamide
CID 107234053
2-ethyl-N-[[4-(hydroxymethyl)phenyl]methyl]-1H-imidazole-5-sulfonamide
CID 107232013

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropylpropyl)-2-ethyl-1H-imidazole-5-sulfonamide?
The IUPAC name of N-(2-cyclopropylpropyl)-2-ethyl-1H-imidazole-5-sulfonamide (CID 113476004) is N-(2-cyclopropylpropyl)-2-ethyl-1H-imidazole-5-sulfonamide.
What is the SMILES notation for N-(2-cyclopropylpropyl)-2-ethyl-1H-imidazole-5-sulfonamide?
The canonical SMILES for N-(2-cyclopropylpropyl)-2-ethyl-1H-imidazole-5-sulfonamide is CCc1ncc(S(=O)(=O)NCC(C)C2CC2)[nH]1.
What is the InChIKey of N-(2-cyclopropylpropyl)-2-ethyl-1H-imidazole-5-sulfonamide?
The InChIKey is OWHVZPZGKFVXEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2S/c1-3-10-12-7-11(14-10)17(15,16)13-6-8(2)9-4-5-9/h7-9,13H,3-6H2,1-2H3,(H,12,14).
What are the key properties of N-(2-cyclopropylpropyl)-2-ethyl-1H-imidazole-5-sulfonamide?
N-(2-cyclopropylpropyl)-2-ethyl-1H-imidazole-5-sulfonamide has a molecular weight of 257.36 g/mol, XLogP of 1.30, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropylpropyl)-2-ethyl-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 113476004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).