(S)-(2-propan-2-ylphenyl)-thiophen-3-ylmethanol

C14H16OS — CID 97293180

IUPAC(S)-(2-propan-2-ylphenyl)-thiophen-3-ylmethanol
SMILESCC(C)c1ccccc1[C@H](O)c1ccsc1
InChIInChI=1S/C14H16OS/c1-10(2)12-5-3-4-6-13(12)14(15)11-7-8-16-9-11/h3-10,14-15H,1-2H3/t14-/m1/s1
InChIKeyYVGVJBLJPQEUBO-CQSZACIVSA-N
MW232.35 g/mol
LogP3.95
Rot. Bonds3

About (S)-(2-propan-2-ylphenyl)-thiophen-3-ylmethanol

(S)-(2-propan-2-ylphenyl)-thiophen-3-ylmethanol (PubChem CID 97293180) has the molecular formula C14H16OS and a molecular weight of 232.35 g/mol. Its IUPAC name is (S)-(2-propan-2-ylphenyl)-thiophen-3-ylmethanol.

Molecular Properties

Compound Name(S)-(2-propan-2-ylphenyl)-thiophen-3-ylmethanol
PubChem CID97293180
Molecular FormulaC14H16OS
Molecular Weight232.35 g/mol
Exact Mass232.09
IUPAC Name(S)-(2-propan-2-ylphenyl)-thiophen-3-ylmethanol
SMILESCC(C)c1ccccc1[C@H](O)c1ccsc1
InChIInChI=1S/C14H16OS/c1-10(2)12-5-3-4-6-13(12)14(15)11-7-8-16-9-11/h3-10,14-15H,1-2H3/t14-/m1/s1
InChIKeyYVGVJBLJPQEUBO-CQSZACIVSA-N
XLogP3.95
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (S)-(2-propan-2-ylphenyl)-thiophen-3-ylmethanol 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

2-[hydroxy(thiophen-3-yl)methyl]phenol
CID 155686195
[2,4-di(propan-2-yl)phenyl]-thiophen-3-ylmethanol
CID 61087925
(R)-(2-methoxyphenyl)-thiophen-3-ylmethanol
CID 93312294
(1S)-1-thiophen-3-ylethanol
CID 11297979
1-thiophen-3-ylethanol
CID 12744375
(2-methylthiophen-3-yl)-thiophen-3-ylmethanol
CID 102829147
(3-bromo-2-chlorophenyl)-thiophen-3-ylmethanol
CID 115805570
(R)-1-benzofuran-3-yl(thiophen-3-yl)methanol
CID 155933737
quinoxalin-5-yl(thiophen-3-yl)methanol
CID 105102725
1-[3-[hydroxy(thiophen-3-yl)methyl]furan-2-yl]-2,2-dimethylpropan-1-ol
CID 101472841
(2,6-dimethyl-3-pyridinyl)-thiophen-3-ylmethanol
CID 105102734
1,2-di(propan-2-yl)benzene;1-sulfanylethanol
CID 174932639

Frequently Asked Questions

What is the IUPAC name of (S)-(2-propan-2-ylphenyl)-thiophen-3-ylmethanol?
The IUPAC name of (S)-(2-propan-2-ylphenyl)-thiophen-3-ylmethanol (CID 97293180) is (S)-(2-propan-2-ylphenyl)-thiophen-3-ylmethanol.
What is the SMILES notation for (S)-(2-propan-2-ylphenyl)-thiophen-3-ylmethanol?
The canonical SMILES for (S)-(2-propan-2-ylphenyl)-thiophen-3-ylmethanol is CC(C)c1ccccc1[C@H](O)c1ccsc1.
What is the InChIKey of (S)-(2-propan-2-ylphenyl)-thiophen-3-ylmethanol?
The InChIKey is YVGVJBLJPQEUBO-CQSZACIVSA-N. The full InChI is InChI=1S/C14H16OS/c1-10(2)12-5-3-4-6-13(12)14(15)11-7-8-16-9-11/h3-10,14-15H,1-2H3/t14-/m1/s1.
What are the key properties of (S)-(2-propan-2-ylphenyl)-thiophen-3-ylmethanol?
(S)-(2-propan-2-ylphenyl)-thiophen-3-ylmethanol has a molecular weight of 232.35 g/mol, XLogP of 3.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (S)-(2-propan-2-ylphenyl)-thiophen-3-ylmethanol is sourced from PubChem (CID 97293180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).