2-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-1-ol

C8H13NOS2 — CID 127002555

IUPAC2-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-1-ol
SMILESCc1csc(SC(C)(C)CO)n1
InChIInChI=1S/C8H13NOS2/c1-6-4-11-7(9-6)12-8(2,3)5-10/h4,10H,5H2,1-3H3
InChIKeyRZHTURLNBPSZFO-UHFFFAOYSA-N
MW203.33 g/mol
LogP2.31
Rot. Bonds3

About 2-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-1-ol

2-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-1-ol (PubChem CID 127002555) has the molecular formula C8H13NOS2 and a molecular weight of 203.33 g/mol. Its IUPAC name is 2-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-1-ol.

Molecular Properties

Compound Name2-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-1-ol
PubChem CID127002555
Molecular FormulaC8H13NOS2
Molecular Weight203.33 g/mol
Exact Mass203.04
IUPAC Name2-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-1-ol
SMILESCc1csc(SC(C)(C)CO)n1
InChIInChI=1S/C8H13NOS2/c1-6-4-11-7(9-6)12-8(2,3)5-10/h4,10H,5H2,1-3H3
InChIKeyRZHTURLNBPSZFO-UHFFFAOYSA-N
XLogP2.31
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-1-ol
CID 115742698
sodium 2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]acetate
CID 84818244
1-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-2-one
CID 43414039
2-methyl-2-[(4-methyl-1,3-thiazol-2-yl)amino]propan-1-ol
CID 43500206
methyl 2,2-dimethyl-3-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propanoate
CID 79629528
3-amino-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]butan-1-ol
CID 64897892
2-(3,6-dimethylpyrazin-2-yl)sulfanyl-2-methylpropan-1-ol
CID 130668327
2-[(4-bromo-1,3-thiazol-2-yl)sulfanyl]-4-methyl-1,3-thiazole
CID 79400180
[6-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-pyridinyl]methanol
CID 80651278
1-amino-3-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-2-ol
CID 43188142
[5-methyl-6-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-pyridinyl]methanol
CID 80651358
[3-fluoro-5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]phenyl]methanol
CID 106533853

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-1-ol?
The IUPAC name of 2-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-1-ol (CID 127002555) is 2-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-1-ol.
What is the SMILES notation for 2-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-1-ol?
The canonical SMILES for 2-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-1-ol is Cc1csc(SC(C)(C)CO)n1.
What is the InChIKey of 2-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-1-ol?
The InChIKey is RZHTURLNBPSZFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NOS2/c1-6-4-11-7(9-6)12-8(2,3)5-10/h4,10H,5H2,1-3H3.
What are the key properties of 2-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-1-ol?
2-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-1-ol has a molecular weight of 203.33 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]propan-1-ol is sourced from PubChem (CID 127002555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).