N-ethyl-1-methylimidazole-2-sulfonamide

C6H11N3O2S — CID 130916931

IUPACN-ethyl-1-methylimidazole-2-sulfonamide
SMILESCCNS(=O)(=O)c1nccn1C
InChIInChI=1S/C6H11N3O2S/c1-3-8-12(10,11)6-7-4-5-9(6)2/h4-5,8H,3H2,1-2H3
InChIKeyWATOSQZXIQPHKF-UHFFFAOYSA-N
MW189.24 g/mol
LogP-0.28
Rot. Bonds3

About N-ethyl-1-methylimidazole-2-sulfonamide

N-ethyl-1-methylimidazole-2-sulfonamide (PubChem CID 130916931) has the molecular formula C6H11N3O2S and a molecular weight of 189.24 g/mol. Its IUPAC name is N-ethyl-1-methylimidazole-2-sulfonamide.

Molecular Properties

Compound NameN-ethyl-1-methylimidazole-2-sulfonamide
PubChem CID130916931
Molecular FormulaC6H11N3O2S
Molecular Weight189.24 g/mol
Exact Mass189.06
IUPAC NameN-ethyl-1-methylimidazole-2-sulfonamide
SMILESCCNS(=O)(=O)c1nccn1C
InChIInChI=1S/C6H11N3O2S/c1-3-8-12(10,11)6-7-4-5-9(6)2/h4-5,8H,3H2,1-2H3
InChIKeyWATOSQZXIQPHKF-UHFFFAOYSA-N
XLogP-0.28
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.24
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[ethyl-(1-methylimidazol-2-yl)-oxo-λ6-sulfanylidene]sulfamoyl chloride
CID 125425011
(1S)-N-ethyl-1-(1-methylimidazol-2-yl)ethanesulfonamide
CID 97177613
N-ethyl-1-(1-methylimidazol-2-yl)ethanesulfonamide
CID 71635426
1-methylimidazole-2-sulfonic acid;hydrochloride
CID 174969416
1-(3-hydroxypropyl)-3-(1-methylimidazol-2-yl)sulfonylurea
CID 154849339
N-ethylpyrimidine-2-sulfonamide
CID 71635439
1-(1-methylimidazol-2-yl)sulfonylethanamine;hydrochloride
CID 22018176
6-(ethylamino)-N-[(1-methylimidazol-2-yl)methyl]pyridine-3-sulfonamide
CID 63296118
2-(ethylsulfonylmethyl)-1-methylimidazole
CID 117187200
N-ethyl-1-(1-propan-2-ylimidazol-2-yl)methanesulfonamide
CID 71635472
N,N-dimethyl-3-(1-methylimidazol-2-yl)sulfonylpropan-1-amine
CID 141130547
1-methyl-2-(2,4,6-trimethylphenyl)sulfonylimidazole
CID 70402886

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-methylimidazole-2-sulfonamide?
The IUPAC name of N-ethyl-1-methylimidazole-2-sulfonamide (CID 130916931) is N-ethyl-1-methylimidazole-2-sulfonamide.
What is the SMILES notation for N-ethyl-1-methylimidazole-2-sulfonamide?
The canonical SMILES for N-ethyl-1-methylimidazole-2-sulfonamide is CCNS(=O)(=O)c1nccn1C.
What is the InChIKey of N-ethyl-1-methylimidazole-2-sulfonamide?
The InChIKey is WATOSQZXIQPHKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O2S/c1-3-8-12(10,11)6-7-4-5-9(6)2/h4-5,8H,3H2,1-2H3.
What are the key properties of N-ethyl-1-methylimidazole-2-sulfonamide?
N-ethyl-1-methylimidazole-2-sulfonamide has a molecular weight of 189.24 g/mol, XLogP of -0.28, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-methylimidazole-2-sulfonamide is sourced from PubChem (CID 130916931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).