(2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide

C8H12N2O3S2 — CID 94024935

IUPAC(2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide
SMILESCc1cnc(NC(=O)[C@@H](C)S(C)(=O)=O)s1
InChIInChI=1S/C8H12N2O3S2/c1-5-4-9-8(14-5)10-7(11)6(2)15(3,12)13/h4,6H,1-3H3,(H,9,10,11)/t6-/m1/s1
InChIKeyYIBIQMWCANORHC-ZCFIWIBFSA-N
MW248.33 g/mol
LogP0.82
Rot. Bonds3

About (2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide

(2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide (PubChem CID 94024935) has the molecular formula C8H12N2O3S2 and a molecular weight of 248.33 g/mol. Its IUPAC name is (2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name(2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide
PubChem CID94024935
Molecular FormulaC8H12N2O3S2
Molecular Weight248.33 g/mol
Exact Mass248.03
IUPAC Name(2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide
SMILESCc1cnc(NC(=O)[C@@H](C)S(C)(=O)=O)s1
InChIInChI=1S/C8H12N2O3S2/c1-5-4-9-8(14-5)10-7(11)6(2)15(3,12)13/h4,6H,1-3H3,(H,9,10,11)/t6-/m1/s1
InChIKeyYIBIQMWCANORHC-ZCFIWIBFSA-N
XLogP0.82
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[5-[(2,4-difluorophenyl)methyl]-1,3-thiazol-2-yl]-2-methylsulfonylpropanamide
CID 51125724
2-chloro-N-[(5-methyl-1,3-thiazol-2-yl)carbamoyl]propanamide
CID 43146246
(2S)-2-[(4-acetamidophenyl)sulfonylamino]-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 55936156
3-amino-4-[(5-methyl-1,3-thiazol-2-yl)amino]-4-oxobutanoic acid
CID 64894875
N-(5-methyl-1,3-thiazol-2-yl)-2-phenoxypropanamide
CID 4812532
(2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-pyrazol-1-ylpropanamide
CID 35556893
1-methyl-3-(5-methyl-1,3-thiazol-2-yl)urea
CID 59293942
2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide
CID 3979206
(2R)-2-(4-chlorophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 2678069
2-(4-bromophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 17190941
2-[ethylsulfonyl(2-methylpropyl)amino]-N-(5-methyl-1,3-thiazol-2-yl)acetamide
CID 42770884
1-(1-hydroxypropan-2-yl)-3-(5-methyl-1,3-thiazol-2-yl)urea
CID 47196994

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide?
The IUPAC name of (2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide (CID 94024935) is (2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for (2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide?
The canonical SMILES for (2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide is Cc1cnc(NC(=O)[C@@H](C)S(C)(=O)=O)s1.
What is the InChIKey of (2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide?
The InChIKey is YIBIQMWCANORHC-ZCFIWIBFSA-N. The full InChI is InChI=1S/C8H12N2O3S2/c1-5-4-9-8(14-5)10-7(11)6(2)15(3,12)13/h4,6H,1-3H3,(H,9,10,11)/t6-/m1/s1.
What are the key properties of (2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide?
(2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide has a molecular weight of 248.33 g/mol, XLogP of 0.82, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 94024935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).