N-(2-hydroxyethyl)-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide

C8H11N3O3S2 — CID 23449148

IUPACN-(2-hydroxyethyl)-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide
SMILESCN(CCO)S(=O)(=O)c1ncn2ccsc12
InChIInChI=1S/C8H11N3O3S2/c1-10(2-4-12)16(13,14)7-8-11(6-9-7)3-5-15-8/h3,5-6,12H,2,4H2,1H3
InChIKeyMIHBSSBLPYKUMP-UHFFFAOYSA-N
MW261.33 g/mol
LogP0.01
Rot. Bonds4

About N-(2-hydroxyethyl)-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide

N-(2-hydroxyethyl)-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide (PubChem CID 23449148) has the molecular formula C8H11N3O3S2 and a molecular weight of 261.33 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide
PubChem CID23449148
Molecular FormulaC8H11N3O3S2
Molecular Weight261.33 g/mol
Exact Mass261.02
IUPAC NameN-(2-hydroxyethyl)-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide
SMILESCN(CCO)S(=O)(=O)c1ncn2ccsc12
InChIInChI=1S/C8H11N3O3S2/c1-10(2-4-12)16(13,14)7-8-11(6-9-7)3-5-15-8/h3,5-6,12H,2,4H2,1H3
InChIKeyMIHBSSBLPYKUMP-UHFFFAOYSA-N
XLogP0.01
TPSA74.91 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide?
The IUPAC name of N-(2-hydroxyethyl)-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide (CID 23449148) is N-(2-hydroxyethyl)-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide is CN(CCO)S(=O)(=O)c1ncn2ccsc12.
What is the InChIKey of N-(2-hydroxyethyl)-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide?
The InChIKey is MIHBSSBLPYKUMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O3S2/c1-10(2-4-12)16(13,14)7-8-11(6-9-7)3-5-15-8/h3,5-6,12H,2,4H2,1H3.
What are the key properties of N-(2-hydroxyethyl)-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide?
N-(2-hydroxyethyl)-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide has a molecular weight of 261.33 g/mol, XLogP of 0.01, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide is sourced from PubChem (CID 23449148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).