(5-ethylthiophen-2-yl)-(2,3,4,5,6-pentamethylphenyl)methanol

C18H24OS — CID 63426088

IUPAC(5-ethylthiophen-2-yl)-(2,3,4,5,6-pentamethylphenyl)methanol
SMILESCCc1ccc(C(O)c2c(C)c(C)c(C)c(C)c2C)s1
InChIInChI=1S/C18H24OS/c1-7-15-8-9-16(20-15)18(19)17-13(5)11(3)10(2)12(4)14(17)6/h8-9,18-19H,7H2,1-6H3
InChIKeyLAUOYELLQXHDGF-UHFFFAOYSA-N
MW288.46 g/mol
LogP4.93
Rot. Bonds3

About (5-ethylthiophen-2-yl)-(2,3,4,5,6-pentamethylphenyl)methanol

(5-ethylthiophen-2-yl)-(2,3,4,5,6-pentamethylphenyl)methanol (PubChem CID 63426088) has the molecular formula C18H24OS and a molecular weight of 288.46 g/mol. Its IUPAC name is (5-ethylthiophen-2-yl)-(2,3,4,5,6-pentamethylphenyl)methanol.

Molecular Properties

Compound Name(5-ethylthiophen-2-yl)-(2,3,4,5,6-pentamethylphenyl)methanol
PubChem CID63426088
Molecular FormulaC18H24OS
Molecular Weight288.46 g/mol
Exact Mass288.15
IUPAC Name(5-ethylthiophen-2-yl)-(2,3,4,5,6-pentamethylphenyl)methanol
SMILESCCc1ccc(C(O)c2c(C)c(C)c(C)c(C)c2C)s1
InChIInChI=1S/C18H24OS/c1-7-15-8-9-16(20-15)18(19)17-13(5)11(3)10(2)12(4)14(17)6/h8-9,18-19H,7H2,1-6H3
InChIKeyLAUOYELLQXHDGF-UHFFFAOYSA-N
XLogP4.93
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.46
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[bromo-(2,3,4,5,6-pentamethylphenyl)methyl]-5-ethylthiophene
CID 63438170
(5-ethylthiophen-2-yl)-(2-methylnaphthalen-1-yl)methanol
CID 81432036
(3,4-dimethylphenyl)-(5-ethylthiophen-2-yl)methanol
CID 61100003
(2,5-dimethylfuran-3-yl)-(5-ethylthiophen-2-yl)methanol
CID 61099322
3-(5-ethylthiophen-2-yl)butan-2-ol
CID 66436532
(2,4-difluoro-5-methylphenyl)-(5-ethylthiophen-2-yl)methanol
CID 79731435
(5-bromo-2,4-dimethylphenyl)-(5-ethylthiophen-2-yl)methanol
CID 90394992
(5-bromo-3-methyltriazol-4-yl)-(5-ethylthiophen-2-yl)methanol
CID 106461206
1-(5-ethylthiophen-2-yl)-2,2,2-trifluoroethanol
CID 61101723
(3-bromothiophen-2-yl)-(5-ethylthiophen-2-yl)methanol
CID 63796271
(5-chloro-2-fluorophenyl)-(5-ethylthiophen-2-yl)methanol
CID 61101728
2-(4-ethylphenyl)-1-(5-ethylthiophen-2-yl)ethanol
CID 63896090

Frequently Asked Questions

What is the IUPAC name of (5-ethylthiophen-2-yl)-(2,3,4,5,6-pentamethylphenyl)methanol?
The IUPAC name of (5-ethylthiophen-2-yl)-(2,3,4,5,6-pentamethylphenyl)methanol (CID 63426088) is (5-ethylthiophen-2-yl)-(2,3,4,5,6-pentamethylphenyl)methanol.
What is the SMILES notation for (5-ethylthiophen-2-yl)-(2,3,4,5,6-pentamethylphenyl)methanol?
The canonical SMILES for (5-ethylthiophen-2-yl)-(2,3,4,5,6-pentamethylphenyl)methanol is CCc1ccc(C(O)c2c(C)c(C)c(C)c(C)c2C)s1.
What is the InChIKey of (5-ethylthiophen-2-yl)-(2,3,4,5,6-pentamethylphenyl)methanol?
The InChIKey is LAUOYELLQXHDGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24OS/c1-7-15-8-9-16(20-15)18(19)17-13(5)11(3)10(2)12(4)14(17)6/h8-9,18-19H,7H2,1-6H3.
What are the key properties of (5-ethylthiophen-2-yl)-(2,3,4,5,6-pentamethylphenyl)methanol?
(5-ethylthiophen-2-yl)-(2,3,4,5,6-pentamethylphenyl)methanol has a molecular weight of 288.46 g/mol, XLogP of 4.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-ethylthiophen-2-yl)-(2,3,4,5,6-pentamethylphenyl)methanol is sourced from PubChem (CID 63426088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).