[4-methyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-5-yl]methanol

C9H16N2O3S2 — CID 79859253

IUPAC[4-methyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-5-yl]methanol
SMILESCc1nc(N(C)CCS(C)(=O)=O)sc1CO
InChIInChI=1S/C9H16N2O3S2/c1-7-8(6-12)15-9(10-7)11(2)4-5-16(3,13)14/h12H,4-6H2,1-3H3
InChIKeyNHNHNHLSIAAMHZ-UHFFFAOYSA-N
MW264.37 g/mol
LogP0.42
Rot. Bonds5

About [4-methyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-5-yl]methanol

[4-methyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-5-yl]methanol (PubChem CID 79859253) has the molecular formula C9H16N2O3S2 and a molecular weight of 264.37 g/mol. Its IUPAC name is [4-methyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[4-methyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-5-yl]methanol
PubChem CID79859253
Molecular FormulaC9H16N2O3S2
Molecular Weight264.37 g/mol
Exact Mass264.06
IUPAC Name[4-methyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-5-yl]methanol
SMILESCc1nc(N(C)CCS(C)(=O)=O)sc1CO
InChIInChI=1S/C9H16N2O3S2/c1-7-8(6-12)15-9(10-7)11(2)4-5-16(3,13)14/h12H,4-6H2,1-3H3
InChIKeyNHNHNHLSIAAMHZ-UHFFFAOYSA-N
XLogP0.42
TPSA70.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [4-methyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-5-yl]methanol 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

1-[4-methyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-5-yl]ethanone
CID 79858127
5-[(tert-butylamino)methyl]-4-ethyl-N-methyl-N-(2-methylsulfonylethyl)-1,3-thiazol-2-amine
CID 79843946
[2-[(3-bromophenyl)methyl-methylamino]-4-methyl-1,3-thiazol-5-yl]methanol
CID 62780698
[2-[cyclopropyl(methyl)amino]-4-methyl-1,3-thiazol-5-yl]methanol
CID 62780671
4-bromo-N-methyl-N-(2-methylsulfonylethyl)-1,3-thiazol-2-amine
CID 79864884
4-cyclopropyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazole-5-carbaldehyde
CID 79858130
[6-[methyl(2-methylsulfonylethyl)amino]-3-pyridinyl]methanol
CID 79849577
[4-methyl-2-(N,2,4-trimethylanilino)-1,3-thiazol-5-yl]methanol
CID 55117860
5-(ethylaminomethyl)-N,4-dimethyl-N-(2-methylsulfanylethyl)-1,3-thiazol-2-amine
CID 112666477
5-(aminomethyl)-N,4-dimethyl-N-pentyl-1,3-thiazol-2-amine
CID 62768133
methyl 3-[2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-4-yl]propanoate
CID 107040512
N-methyl-4-(methylaminomethyl)-N-(2-methylsulfonylethyl)-1,3-thiazol-2-amine
CID 79859441

Frequently Asked Questions

What is the IUPAC name of [4-methyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-5-yl]methanol?
The IUPAC name of [4-methyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-5-yl]methanol (CID 79859253) is [4-methyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [4-methyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [4-methyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-5-yl]methanol is Cc1nc(N(C)CCS(C)(=O)=O)sc1CO.
What is the InChIKey of [4-methyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-5-yl]methanol?
The InChIKey is NHNHNHLSIAAMHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O3S2/c1-7-8(6-12)15-9(10-7)11(2)4-5-16(3,13)14/h12H,4-6H2,1-3H3.
What are the key properties of [4-methyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-5-yl]methanol?
[4-methyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-5-yl]methanol has a molecular weight of 264.37 g/mol, XLogP of 0.42, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-2-[methyl(2-methylsulfonylethyl)amino]-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 79859253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).