(3-cyclopropylphenyl)-(3-methylthiophen-2-yl)methanol

C15H16OS — CID 79991292

IUPAC(3-cyclopropylphenyl)-(3-methylthiophen-2-yl)methanol
SMILESCc1ccsc1C(O)c1cccc(C2CC2)c1
InChIInChI=1S/C15H16OS/c1-10-7-8-17-15(10)14(16)13-4-2-3-12(9-13)11-5-6-11/h2-4,7-9,11,14,16H,5-6H2,1H3
InChIKeyJMOYVIDIEPRUII-UHFFFAOYSA-N
MW244.36 g/mol
LogP4.02
Rot. Bonds3

About (3-cyclopropylphenyl)-(3-methylthiophen-2-yl)methanol

(3-cyclopropylphenyl)-(3-methylthiophen-2-yl)methanol (PubChem CID 79991292) has the molecular formula C15H16OS and a molecular weight of 244.36 g/mol. Its IUPAC name is (3-cyclopropylphenyl)-(3-methylthiophen-2-yl)methanol.

Molecular Properties

Compound Name(3-cyclopropylphenyl)-(3-methylthiophen-2-yl)methanol
PubChem CID79991292
Molecular FormulaC15H16OS
Molecular Weight244.36 g/mol
Exact Mass244.09
IUPAC Name(3-cyclopropylphenyl)-(3-methylthiophen-2-yl)methanol
SMILESCc1ccsc1C(O)c1cccc(C2CC2)c1
InChIInChI=1S/C15H16OS/c1-10-7-8-17-15(10)14(16)13-4-2-3-12(9-13)11-5-6-11/h2-4,7-9,11,14,16H,5-6H2,1H3
InChIKeyJMOYVIDIEPRUII-UHFFFAOYSA-N
XLogP4.02
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 ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3-cyclopropylphenyl)-hydroxymethyl]thiophene-3-carboxylic acid
CID 107432406
(3-bromothiophen-2-yl)-(3-cyclobutylphenyl)methanol
CID 114601538
(3-chloro-4-methylthiophen-2-yl)-(3-cyclobutylphenyl)methanol
CID 103408312
(3-cyclopropylphenyl)-(2,4,5-trimethylphenyl)methanol
CID 79980572
(3-cyclopropylphenyl)-(3-fluoro-4-methylphenyl)methanol
CID 107128110
(3,4-dimethylphenyl)-(3-methylthiophen-2-yl)methanol
CID 61101702
(3-cyclopropylphenyl)-(2,3-difluoro-4-methylphenyl)methanol
CID 107512296
(3-ethoxyphenyl)-(3-methylthiophen-2-yl)methanol
CID 79992255
(3-cyclobutylphenyl)-(1,3-thiazol-2-yl)methanol
CID 114601615
(3-cyclopropylphenyl)-(7-methyl-1-benzofuran-2-yl)methanol
CID 114724253
2-(3-bromothiophen-2-yl)-1-(3-cyclopropylphenyl)ethanol
CID 79980714
(4-chlorophenyl)-(3-cyclopropylphenyl)methanol
CID 79979843

Frequently Asked Questions

What is the IUPAC name of (3-cyclopropylphenyl)-(3-methylthiophen-2-yl)methanol?
The IUPAC name of (3-cyclopropylphenyl)-(3-methylthiophen-2-yl)methanol (CID 79991292) is (3-cyclopropylphenyl)-(3-methylthiophen-2-yl)methanol.
What is the SMILES notation for (3-cyclopropylphenyl)-(3-methylthiophen-2-yl)methanol?
The canonical SMILES for (3-cyclopropylphenyl)-(3-methylthiophen-2-yl)methanol is Cc1ccsc1C(O)c1cccc(C2CC2)c1.
What is the InChIKey of (3-cyclopropylphenyl)-(3-methylthiophen-2-yl)methanol?
The InChIKey is JMOYVIDIEPRUII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16OS/c1-10-7-8-17-15(10)14(16)13-4-2-3-12(9-13)11-5-6-11/h2-4,7-9,11,14,16H,5-6H2,1H3.
What are the key properties of (3-cyclopropylphenyl)-(3-methylthiophen-2-yl)methanol?
(3-cyclopropylphenyl)-(3-methylthiophen-2-yl)methanol has a molecular weight of 244.36 g/mol, XLogP of 4.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclopropylphenyl)-(3-methylthiophen-2-yl)methanol is sourced from PubChem (CID 79991292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).