5-methylsulfonyl-4-phenyl-1,3-thiazol-2-amine

C10H10N2O2S2 — CID 26597941

IUPAC5-methylsulfonyl-4-phenyl-1,3-thiazol-2-amine
SMILESCS(=O)(=O)c1sc(N)nc1-c1ccccc1
InChIInChI=1S/C10H10N2O2S2/c1-16(13,14)9-8(12-10(11)15-9)7-5-3-2-4-6-7/h2-6H,1H3,(H2,11,12)
InChIKeyMENYNNGOWMJUEG-UHFFFAOYSA-N
MW254.34 g/mol
LogP1.80
Rot. Bonds2

About 5-methylsulfonyl-4-phenyl-1,3-thiazol-2-amine

5-methylsulfonyl-4-phenyl-1,3-thiazol-2-amine (PubChem CID 26597941) has the molecular formula C10H10N2O2S2 and a molecular weight of 254.34 g/mol. Its IUPAC name is 5-methylsulfonyl-4-phenyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-methylsulfonyl-4-phenyl-1,3-thiazol-2-amine
PubChem CID26597941
Molecular FormulaC10H10N2O2S2
Molecular Weight254.34 g/mol
Exact Mass254.02
IUPAC Name5-methylsulfonyl-4-phenyl-1,3-thiazol-2-amine
SMILESCS(=O)(=O)c1sc(N)nc1-c1ccccc1
InChIInChI=1S/C10H10N2O2S2/c1-16(13,14)9-8(12-10(11)15-9)7-5-3-2-4-6-7/h2-6H,1H3,(H2,11,12)
InChIKeyMENYNNGOWMJUEG-UHFFFAOYSA-N
XLogP1.80
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.34
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methylsulfonyl-4-phenyl-1,3-thiazol-2-amine?
The IUPAC name of 5-methylsulfonyl-4-phenyl-1,3-thiazol-2-amine (CID 26597941) is 5-methylsulfonyl-4-phenyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-methylsulfonyl-4-phenyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-methylsulfonyl-4-phenyl-1,3-thiazol-2-amine is CS(=O)(=O)c1sc(N)nc1-c1ccccc1.
What is the InChIKey of 5-methylsulfonyl-4-phenyl-1,3-thiazol-2-amine?
The InChIKey is MENYNNGOWMJUEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2S2/c1-16(13,14)9-8(12-10(11)15-9)7-5-3-2-4-6-7/h2-6H,1H3,(H2,11,12).
What are the key properties of 5-methylsulfonyl-4-phenyl-1,3-thiazol-2-amine?
5-methylsulfonyl-4-phenyl-1,3-thiazol-2-amine has a molecular weight of 254.34 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylsulfonyl-4-phenyl-1,3-thiazol-2-amine is sourced from PubChem (CID 26597941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).