N-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide

C10H10N2O2S2 — CID 47068906

IUPACN-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide
SMILESCN(c1nccs1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C10H10N2O2S2/c1-12(10-11-7-8-15-10)16(13,14)9-5-3-2-4-6-9/h2-8H,1H3
InChIKeyNFSSZVKONUWWDE-UHFFFAOYSA-N
MW254.34 g/mol
LogP1.97
Rot. Bonds3

About N-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide

N-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide (PubChem CID 47068906) has the molecular formula C10H10N2O2S2 and a molecular weight of 254.34 g/mol. Its IUPAC name is N-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide
PubChem CID47068906
Molecular FormulaC10H10N2O2S2
Molecular Weight254.34 g/mol
Exact Mass254.02
IUPAC NameN-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide
SMILESCN(c1nccs1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C10H10N2O2S2/c1-12(10-11-7-8-15-10)16(13,14)9-5-3-2-4-6-9/h2-8H,1H3
InChIKeyNFSSZVKONUWWDE-UHFFFAOYSA-N
XLogP1.97
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.34
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide?
The IUPAC name of N-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide (CID 47068906) is N-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide.
What is the SMILES notation for N-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide?
The canonical SMILES for N-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide is CN(c1nccs1)S(=O)(=O)c1ccccc1.
What is the InChIKey of N-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide?
The InChIKey is NFSSZVKONUWWDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2S2/c1-12(10-11-7-8-15-10)16(13,14)9-5-3-2-4-6-9/h2-8H,1H3.
What are the key properties of N-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide?
N-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide has a molecular weight of 254.34 g/mol, XLogP of 1.97, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1,3-thiazol-2-yl)benzenesulfonamide is sourced from PubChem (CID 47068906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).