(2S)-1-thiophen-3-ylpropan-2-ol

C7H10OS — CID 75406823

IUPAC(2S)-1-thiophen-3-ylpropan-2-ol
SMILESC[C@H](O)Cc1ccsc1
InChIInChI=1S/C7H10OS/c1-6(8)4-7-2-3-9-5-7/h2-3,5-6,8H,4H2,1H3/t6-/m0/s1
InChIKeyTZNKFBAAGCSCIX-LURJTMIESA-N
MW142.22 g/mol
LogP1.67
Rot. Bonds2

About (2S)-1-thiophen-3-ylpropan-2-ol

(2S)-1-thiophen-3-ylpropan-2-ol (PubChem CID 75406823) has the molecular formula C7H10OS and a molecular weight of 142.22 g/mol. Its IUPAC name is (2S)-1-thiophen-3-ylpropan-2-ol.

Molecular Properties

Compound Name(2S)-1-thiophen-3-ylpropan-2-ol
PubChem CID75406823
Molecular FormulaC7H10OS
Molecular Weight142.22 g/mol
Exact Mass142.05
IUPAC Name(2S)-1-thiophen-3-ylpropan-2-ol
SMILESC[C@H](O)Cc1ccsc1
InChIInChI=1S/C7H10OS/c1-6(8)4-7-2-3-9-5-7/h2-3,5-6,8H,4H2,1H3/t6-/m0/s1
InChIKeyTZNKFBAAGCSCIX-LURJTMIESA-N
XLogP1.67
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.22
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-1-thiophen-3-ylpropan-2-ol?
The IUPAC name of (2S)-1-thiophen-3-ylpropan-2-ol (CID 75406823) is (2S)-1-thiophen-3-ylpropan-2-ol.
What is the SMILES notation for (2S)-1-thiophen-3-ylpropan-2-ol?
The canonical SMILES for (2S)-1-thiophen-3-ylpropan-2-ol is C[C@H](O)Cc1ccsc1.
What is the InChIKey of (2S)-1-thiophen-3-ylpropan-2-ol?
The InChIKey is TZNKFBAAGCSCIX-LURJTMIESA-N. The full InChI is InChI=1S/C7H10OS/c1-6(8)4-7-2-3-9-5-7/h2-3,5-6,8H,4H2,1H3/t6-/m0/s1.
What are the key properties of (2S)-1-thiophen-3-ylpropan-2-ol?
(2S)-1-thiophen-3-ylpropan-2-ol has a molecular weight of 142.22 g/mol, XLogP of 1.67, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-thiophen-3-ylpropan-2-ol is sourced from PubChem (CID 75406823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).