(4-cyclobutylphenyl)-thiophen-2-ylmethanol

C15H16OS — CID 116505278

IUPAC(4-cyclobutylphenyl)-thiophen-2-ylmethanol
SMILESOC(c1ccc(C2CCC2)cc1)c1cccs1
InChIInChI=1S/C15H16OS/c16-15(14-5-2-10-17-14)13-8-6-12(7-9-13)11-3-1-4-11/h2,5-11,15-16H,1,3-4H2
InChIKeyYBASDOJRUHTZIX-UHFFFAOYSA-N
MW244.36 g/mol
LogP4.10
Rot. Bonds3

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

(4-cyclobutylphenyl)-thiophen-2-ylmethanol (PubChem CID 116505278) has the molecular formula C15H16OS and a molecular weight of 244.36 g/mol. Its IUPAC name is (4-cyclobutylphenyl)-thiophen-2-ylmethanol.

Molecular Properties

Compound Name(4-cyclobutylphenyl)-thiophen-2-ylmethanol
PubChem CID116505278
Molecular FormulaC15H16OS
Molecular Weight244.36 g/mol
Exact Mass244.09
IUPAC Name(4-cyclobutylphenyl)-thiophen-2-ylmethanol
SMILESOC(c1ccc(C2CCC2)cc1)c1cccs1
InChIInChI=1S/C15H16OS/c16-15(14-5-2-10-17-14)13-8-6-12(7-9-13)11-3-1-4-11/h2,5-11,15-16H,1,3-4H2
InChIKeyYBASDOJRUHTZIX-UHFFFAOYSA-N
XLogP4.10
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.36
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-cyclobutylphenyl)-2-phenylethane-1,2-diol
CID 103459446
(R)-(4-cyclohexylphenyl)-(3-methyl-1,2-thiazol-5-yl)methanol
CID 125494876
(4-cyclohexylphenyl)-(4-iodophenyl)methanol
CID 63427013
(4-ethylphenyl)-thiophen-2-ylmethanol
CID 61104575
(R)-[4-(dimethylamino)phenyl]-thiophen-2-ylmethanol
CID 686964
(4-cyclobutylphenyl)-(3,4,5-trifluorophenyl)methanol
CID 116505320
(4-cyclopropylphenyl)-(5-methylthiophen-2-yl)methanol
CID 79980013
(R)-(4-cyclopropylphenyl)-thiophen-3-ylmethanol
CID 124512337
(3-chloro-2-fluorophenyl)-(4-cyclobutylphenyl)methanol
CID 116505775
1-(4-cyclobutylphenyl)-N-ethyl-2-thiophen-2-ylethanamine
CID 116506059
(4-chloro-3-methylphenyl)-(4-cyclobutylphenyl)methanol
CID 115836307
cyclopentyl(thiophen-2-yl)methanol
CID 43753540

Frequently Asked Questions

What is the IUPAC name of (4-cyclobutylphenyl)-thiophen-2-ylmethanol?
The IUPAC name of (4-cyclobutylphenyl)-thiophen-2-ylmethanol (CID 116505278) is (4-cyclobutylphenyl)-thiophen-2-ylmethanol.
What is the SMILES notation for (4-cyclobutylphenyl)-thiophen-2-ylmethanol?
The canonical SMILES for (4-cyclobutylphenyl)-thiophen-2-ylmethanol is OC(c1ccc(C2CCC2)cc1)c1cccs1.
What is the InChIKey of (4-cyclobutylphenyl)-thiophen-2-ylmethanol?
The InChIKey is YBASDOJRUHTZIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16OS/c16-15(14-5-2-10-17-14)13-8-6-12(7-9-13)11-3-1-4-11/h2,5-11,15-16H,1,3-4H2.
What are the key properties of (4-cyclobutylphenyl)-thiophen-2-ylmethanol?
(4-cyclobutylphenyl)-thiophen-2-ylmethanol has a molecular weight of 244.36 g/mol, XLogP of 4.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclobutylphenyl)-thiophen-2-ylmethanol is sourced from PubChem (CID 116505278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).