N-(1H-imidazol-2-yl)cyclopropanesulfonamide

C6H9N3O2S — CID 64554108

IUPACN-(1H-imidazol-2-yl)cyclopropanesulfonamide
SMILESO=S(=O)(Nc1ncc[nH]1)C1CC1
InChIInChI=1S/C6H9N3O2S/c10-12(11,5-1-2-5)9-6-7-3-4-8-6/h3-5H,1-2H2,(H2,7,8,9)
InChIKeyLAGPBRXQZDJAQM-UHFFFAOYSA-N
MW187.22 g/mol
LogP0.31
Rot. Bonds3

About N-(1H-imidazol-2-yl)cyclopropanesulfonamide

N-(1H-imidazol-2-yl)cyclopropanesulfonamide (PubChem CID 64554108) has the molecular formula C6H9N3O2S and a molecular weight of 187.22 g/mol. Its IUPAC name is N-(1H-imidazol-2-yl)cyclopropanesulfonamide.

Molecular Properties

Compound NameN-(1H-imidazol-2-yl)cyclopropanesulfonamide
PubChem CID64554108
Molecular FormulaC6H9N3O2S
Molecular Weight187.22 g/mol
Exact Mass187.04
IUPAC NameN-(1H-imidazol-2-yl)cyclopropanesulfonamide
SMILESO=S(=O)(Nc1ncc[nH]1)C1CC1
InChIInChI=1S/C6H9N3O2S/c10-12(11,5-1-2-5)9-6-7-3-4-8-6/h3-5H,1-2H2,(H2,7,8,9)
InChIKeyLAGPBRXQZDJAQM-UHFFFAOYSA-N
XLogP0.31
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.22
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1H-imidazol-2-yl)-1,1-dioxothiane-4-sulfonamide
CID 63564868
N-(ethylsulfonimidoyl)-1H-imidazol-2-amine
CID 164657237
N-(dicyclopropylmethyl)-1H-imidazol-2-amine
CID 106568914
N-(propan-2-ylsulfamoyl)-1H-imidazol-2-amine
CID 114810099
N-(1H-imidazol-2-yl)-4-iodobenzenesulfonamide
CID 63564855
N-(1H-imidazol-2-yl)oxane-4-carboxamide
CID 60967951
2-fluoro-N-(1H-imidazol-2-yl)benzenesulfonamide
CID 63563905
2-amino-2-cyclobutyl-N-(1H-imidazol-2-yl)acetamide
CID 130806434
N-(1H-imidazol-2-yl)ethanethioamide
CID 54241450
4-amino-2,6-dichloro-N-(1H-imidazol-2-yl)benzenesulfonamide
CID 63564448
3-chloro-N-(1H-imidazol-2-yl)-2-methylpropane-1-sulfonamide
CID 79586328
N-[(2R)-2-[2-(1H-imidazol-2-yl)ethylamino]propyl]cyclopropanesulfonamide
CID 125441934

Frequently Asked Questions

What is the IUPAC name of N-(1H-imidazol-2-yl)cyclopropanesulfonamide?
The IUPAC name of N-(1H-imidazol-2-yl)cyclopropanesulfonamide (CID 64554108) is N-(1H-imidazol-2-yl)cyclopropanesulfonamide.
What is the SMILES notation for N-(1H-imidazol-2-yl)cyclopropanesulfonamide?
The canonical SMILES for N-(1H-imidazol-2-yl)cyclopropanesulfonamide is O=S(=O)(Nc1ncc[nH]1)C1CC1.
What is the InChIKey of N-(1H-imidazol-2-yl)cyclopropanesulfonamide?
The InChIKey is LAGPBRXQZDJAQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2S/c10-12(11,5-1-2-5)9-6-7-3-4-8-6/h3-5H,1-2H2,(H2,7,8,9).
What are the key properties of N-(1H-imidazol-2-yl)cyclopropanesulfonamide?
N-(1H-imidazol-2-yl)cyclopropanesulfonamide has a molecular weight of 187.22 g/mol, XLogP of 0.31, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-2-yl)cyclopropanesulfonamide is sourced from PubChem (CID 64554108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).