(4-ethylphenyl)-thiophen-2-ylmethanol

C13H14OS — CID 61104575

IUPAC(4-ethylphenyl)-thiophen-2-ylmethanol
SMILESCCc1ccc(C(O)c2cccs2)cc1
InChIInChI=1S/C13H14OS/c1-2-10-5-7-11(8-6-10)13(14)12-4-3-9-15-12/h3-9,13-14H,2H2,1H3
InChIKeyYMTYOPNQANWKSJ-UHFFFAOYSA-N
MW218.32 g/mol
LogP3.39
Rot. Bonds3

About (4-ethylphenyl)-thiophen-2-ylmethanol

(4-ethylphenyl)-thiophen-2-ylmethanol (PubChem CID 61104575) has the molecular formula C13H14OS and a molecular weight of 218.32 g/mol. Its IUPAC name is (4-ethylphenyl)-thiophen-2-ylmethanol.

Molecular Properties

Compound Name(4-ethylphenyl)-thiophen-2-ylmethanol
PubChem CID61104575
Molecular FormulaC13H14OS
Molecular Weight218.32 g/mol
Exact Mass218.08
IUPAC Name(4-ethylphenyl)-thiophen-2-ylmethanol
SMILESCCc1ccc(C(O)c2cccs2)cc1
InChIInChI=1S/C13H14OS/c1-2-10-5-7-11(8-6-10)13(14)12-4-3-9-15-12/h3-9,13-14H,2H2,1H3
InChIKeyYMTYOPNQANWKSJ-UHFFFAOYSA-N
XLogP3.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.32
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-(2-methoxyethyl)phenyl]-thiophen-2-ylmethanol
CID 55133973
(3,4-diethylphenyl)-thiophen-2-ylmethanol
CID 115482624
(R)-[4-(dimethylamino)phenyl]-thiophen-2-ylmethanol
CID 686964
1-(4-ethylphenyl)-N-[(1R)-1-thiophen-2-ylethyl]ethanamine
CID 81409318
2-[(4-ethylphenyl)methylamino]-1-thiophen-2-ylethanol
CID 113239709
1-(4-ethylphenyl)-N-[(1R)-1-thiophen-2-ylethyl]propan-1-amine
CID 81399236
thiophen-2-yl-[4-(trifluoromethoxy)phenyl]methanol
CID 63893402
(4,5-dibromothiophen-2-yl)-(4-ethylphenyl)methanol
CID 80535254
N-[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]-2-phenylacetamide
CID 7669881
[4-(difluoromethyl)phenyl]-(4-ethylphenyl)methanol
CID 115524847
(1R,2S)-1,2-bis(4-ethylphenyl)ethane-1,2-diol
CID 131850770
2-(4-ethylphenyl)-N-(2-hydroxy-2-thiophen-2-ylethyl)acetamide
CID 71990852

Frequently Asked Questions

What is the IUPAC name of (4-ethylphenyl)-thiophen-2-ylmethanol?
The IUPAC name of (4-ethylphenyl)-thiophen-2-ylmethanol (CID 61104575) is (4-ethylphenyl)-thiophen-2-ylmethanol.
What is the SMILES notation for (4-ethylphenyl)-thiophen-2-ylmethanol?
The canonical SMILES for (4-ethylphenyl)-thiophen-2-ylmethanol is CCc1ccc(C(O)c2cccs2)cc1.
What is the InChIKey of (4-ethylphenyl)-thiophen-2-ylmethanol?
The InChIKey is YMTYOPNQANWKSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14OS/c1-2-10-5-7-11(8-6-10)13(14)12-4-3-9-15-12/h3-9,13-14H,2H2,1H3.
What are the key properties of (4-ethylphenyl)-thiophen-2-ylmethanol?
(4-ethylphenyl)-thiophen-2-ylmethanol has a molecular weight of 218.32 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylphenyl)-thiophen-2-ylmethanol is sourced from PubChem (CID 61104575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).