N,N-dimethyl-2-propan-2-yl-1H-imidazole-5-sulfonamide

C8H15N3O2S — CID 124569932

IUPACN,N-dimethyl-2-propan-2-yl-1H-imidazole-5-sulfonamide
SMILESCC(C)c1ncc(S(=O)(=O)N(C)C)[nH]1
InChIInChI=1S/C8H15N3O2S/c1-6(2)8-9-5-7(10-8)14(12,13)11(3)4/h5-6H,1-4H3,(H,9,10)
InChIKeyWQMUTNBYUSQAMC-UHFFFAOYSA-N
MW217.29 g/mol
LogP0.78
Rot. Bonds3

About N,N-dimethyl-2-propan-2-yl-1H-imidazole-5-sulfonamide

N,N-dimethyl-2-propan-2-yl-1H-imidazole-5-sulfonamide (PubChem CID 124569932) has the molecular formula C8H15N3O2S and a molecular weight of 217.29 g/mol. Its IUPAC name is N,N-dimethyl-2-propan-2-yl-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-2-propan-2-yl-1H-imidazole-5-sulfonamide
PubChem CID124569932
Molecular FormulaC8H15N3O2S
Molecular Weight217.29 g/mol
Exact Mass217.09
IUPAC NameN,N-dimethyl-2-propan-2-yl-1H-imidazole-5-sulfonamide
SMILESCC(C)c1ncc(S(=O)(=O)N(C)C)[nH]1
InChIInChI=1S/C8H15N3O2S/c1-6(2)8-9-5-7(10-8)14(12,13)11(3)4/h5-6H,1-4H3,(H,9,10)
InChIKeyWQMUTNBYUSQAMC-UHFFFAOYSA-N
XLogP0.78
TPSA66.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.29
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-propan-2-yl-1H-imidazole-5-sulfonic acid
CID 19864190
2-[ethyl-[(2-propan-2-yl-1H-imidazol-5-yl)sulfonyl]amino]acetic acid
CID 146090786
N-methyl-N-(3-methylsulfanylcyclopentyl)-2-propan-2-yl-1H-imidazole-5-sulfonamide
CID 71982183
N,N-dimethyl-2-propan-2-yl-1H-imidazole-5-carboxamide
CID 131063419
2,5-di(propan-2-yl)-1H-imidazole
CID 161147285
5-fluoro-2-propan-2-yl-1H-imidazole
CID 146392910
N-(2-bromopropyl)-2-ethyl-N-methyl-1H-imidazole-5-sulfonamide
CID 80666785
2-phenyl-2-[(2-propan-2-yl-1H-imidazol-5-yl)sulfonylamino]acetamide
CID 56807002
(2S)-2-[4-[(2-propan-2-yl-1H-imidazol-5-yl)sulfonyl]piperazin-1-yl]butan-1-ol
CID 97239556
5-iodo-2-propan-2-yl-1H-pyrimidin-6-one
CID 60835497
N-[(2R)-2-(4-ethylpiperazin-1-yl)propyl]-2-propan-2-yl-1H-imidazole-5-sulfonamide
CID 99857417
N-[3-(2-fluorophenyl)cyclobutyl]-2-propan-2-yl-1H-imidazole-5-sulfonamide
CID 139011151

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-propan-2-yl-1H-imidazole-5-sulfonamide?
The IUPAC name of N,N-dimethyl-2-propan-2-yl-1H-imidazole-5-sulfonamide (CID 124569932) is N,N-dimethyl-2-propan-2-yl-1H-imidazole-5-sulfonamide.
What is the SMILES notation for N,N-dimethyl-2-propan-2-yl-1H-imidazole-5-sulfonamide?
The canonical SMILES for N,N-dimethyl-2-propan-2-yl-1H-imidazole-5-sulfonamide is CC(C)c1ncc(S(=O)(=O)N(C)C)[nH]1.
What is the InChIKey of N,N-dimethyl-2-propan-2-yl-1H-imidazole-5-sulfonamide?
The InChIKey is WQMUTNBYUSQAMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O2S/c1-6(2)8-9-5-7(10-8)14(12,13)11(3)4/h5-6H,1-4H3,(H,9,10).
What are the key properties of N,N-dimethyl-2-propan-2-yl-1H-imidazole-5-sulfonamide?
N,N-dimethyl-2-propan-2-yl-1H-imidazole-5-sulfonamide has a molecular weight of 217.29 g/mol, XLogP of 0.78, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-propan-2-yl-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 124569932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).