(2S)-2-(5-methylthiophen-2-yl)propan-1-ol

C8H12OS — CID 23660060

IUPAC(2S)-2-(5-methylthiophen-2-yl)propan-1-ol
SMILESCc1ccc([C@@H](C)CO)s1
InChIInChI=1S/C8H12OS/c1-6(5-9)8-4-3-7(2)10-8/h3-4,6,9H,5H2,1-2H3/t6-/m0/s1
InChIKeyARFINLLAFIYEBY-LURJTMIESA-N
MW156.25 g/mol
LogP2.15
Rot. Bonds2

About (2S)-2-(5-methylthiophen-2-yl)propan-1-ol

(2S)-2-(5-methylthiophen-2-yl)propan-1-ol (PubChem CID 23660060) has the molecular formula C8H12OS and a molecular weight of 156.25 g/mol. Its IUPAC name is (2S)-2-(5-methylthiophen-2-yl)propan-1-ol.

Molecular Properties

Compound Name(2S)-2-(5-methylthiophen-2-yl)propan-1-ol
PubChem CID23660060
Molecular FormulaC8H12OS
Molecular Weight156.25 g/mol
Exact Mass156.06
IUPAC Name(2S)-2-(5-methylthiophen-2-yl)propan-1-ol
SMILESCc1ccc([C@@H](C)CO)s1
InChIInChI=1S/C8H12OS/c1-6(5-9)8-4-3-7(2)10-8/h3-4,6,9H,5H2,1-2H3/t6-/m0/s1
InChIKeyARFINLLAFIYEBY-LURJTMIESA-N
XLogP2.15
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.25
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-2-(5-methylthiophen-2-yl)ethanol
CID 56828532
5-(5-methylthiophen-2-yl)hexane-2,3-diol
CID 83929345
2-methyl-1-(5-methylthiophen-2-yl)propan-1-ol
CID 61099304
2-[[(1R)-1-(5-methylthiophen-2-yl)ethyl]amino]ethanol
CID 93025500
2-methylsulfanyl-3-[1-(5-methylthiophen-2-yl)ethylamino]butan-1-ol
CID 115722509
2-(cyclopentylamino)-2-(5-methylthiophen-2-yl)ethanol
CID 61345205
(1S,2R)-1-amino-1-(5-methylthiophen-2-yl)propan-2-ol
CID 130969879
2-chloro-1-(5-methylthiophen-2-yl)ethanol
CID 83001254
1-(5-methylthiophen-2-yl)ethylurea
CID 61356567
(2R)-1-[1-(5-methylthiophen-2-yl)ethylamino]propan-2-ol
CID 103906827
1-(5-methylthiophen-2-yl)-2-propan-2-yloxyethanamine
CID 115577931
N-ethyl-1-(5-methylthiophen-2-yl)ethanamine
CID 24705103

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(5-methylthiophen-2-yl)propan-1-ol?
The IUPAC name of (2S)-2-(5-methylthiophen-2-yl)propan-1-ol (CID 23660060) is (2S)-2-(5-methylthiophen-2-yl)propan-1-ol.
What is the SMILES notation for (2S)-2-(5-methylthiophen-2-yl)propan-1-ol?
The canonical SMILES for (2S)-2-(5-methylthiophen-2-yl)propan-1-ol is Cc1ccc([C@@H](C)CO)s1.
What is the InChIKey of (2S)-2-(5-methylthiophen-2-yl)propan-1-ol?
The InChIKey is ARFINLLAFIYEBY-LURJTMIESA-N. The full InChI is InChI=1S/C8H12OS/c1-6(5-9)8-4-3-7(2)10-8/h3-4,6,9H,5H2,1-2H3/t6-/m0/s1.
What are the key properties of (2S)-2-(5-methylthiophen-2-yl)propan-1-ol?
(2S)-2-(5-methylthiophen-2-yl)propan-1-ol has a molecular weight of 156.25 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(5-methylthiophen-2-yl)propan-1-ol is sourced from PubChem (CID 23660060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).